Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
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Isotopically Labeled
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Found 985 results

Search term: C7H14N2O4S (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
388392

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m0/s1
C7H14N2O4S222.2621799841
811


0 of 2 defined stereocentres - 0/2 defined
InChI=1/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)
C7H14N2O4S222.2621781247211276
7844561

Double-bond stereo
InChI=1/C7H14N2O4S/c1-7(2,14(4,11)12)5-9-13-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+
C7H14N2O4S222.262168148493
17339422

Charge
InChI=1/C6H11N2.CH4O4S/c1-3-8-5-4-7(2)6-8;1-5-6(2,3)4/h4-6H,3H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1
C7H14N2O4S222.2621525400
9681617

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C6H10N2O.CH4O3S/c7-6(9)5-2-3-1-4(3)8-5;1-5(2,3)4/h3-5,8H,1-2H2,(H2,7,9);1H3,(H,2,3,4)/t3-,4-,5-;/m0./s1
C7H14N2O4S222.2621412600
7845475

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C7H14N2O4S/c1-5(6(2)14(4,11)12)9-13-7(10)8-3/h6H,1-4H3,(H,8,10)/b9-5+
C7H14N2O4S222.2621394700
9754212

Charge
InChI=1/C6H11N2.CH4O4S/c1-6-7(2)4-5-8(6)3;1-5-6(2,3)4/h4-5H,1-3H3;1H3,(H,2,3,4)/q+1;/p-1
C7H14N2O4S222.2621373600
8280480

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5?/m0/s1
C7H14N2O4S222.26213527211276
2052671

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C7H14N2O4S/c1-2-13-7(10)9-6-4-14(11,12)3-5(6)8/h5-6H,2-4,8H2,1H3,(H,9,10)
C7H14N2O4S222.26206332500
30689604
InChI=1/C7H14N2O4S/c1-7(2,3)13-6(10)9-5-4-8-14(9,11)12/h8H,4-5H2,1-3H3
C7H14N2O4S222.2621272200
2347586

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C7H14N2O4S/c10-3-2-8-7(11)9-6-1-4-14(12,13)5-6/h6,10H,1-5H2,(H2,8,9,11)
C7H14N2O4S222.26206251400
17364634
InChI=1/C7H14N2O4S/c1-14(12,13)9-4-2-8(3-5-9)6-7(10)11/h2-6H2,1H3,(H,10,11)
C7H14N2O4S222.2621241700
21636906
InChI=1/C7H14N2O4S/c1-13-7(10)6-2-4-9(5-3-6)14(8,11)12/h6H,2-5H2,1H3,(H2,8,11,12)
C7H14N2O4S222.2621241600
17344781

Charge
InChI=1/C6H11N2.CH4O4S/c1-6-4-7(2)8(3)5-6;1-5-6(2,3)4/h4-5H,1-3H3;1H3,(H,2,3,4)/q+1;/p-1
C7H14N2O4S222.2621221700
25997236

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C7H14N2O4S/c1-2-13-7(10)6-4-3-5-9(6)14(8,11)12/h6H,2-5H2,1H3,(H2,8,11,12)
C7H14N2O4S222.2621211600
17825220

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C7H14N2O4S/c1-8(2)14(12,13)9-5-3-4-6(9)7(10)11/h6H,3-5H2,1-2H3,(H,10,11)
C7H14N2O4S222.2621191000
55798

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C7H14N2O4S/c1-5(6(2)14(4,11)12)9-13-7(10)8-3/h6H,1-4H3,(H,8,10)
C7H14N2O4S222.2621182000
30744209
InChI=1/C7H14N2O4S/c1-8(13-2)7(10)6-4-9(5-6)14(3,11)12/h6H,4-5H2,1-3H3
C7H14N2O4S222.2621181400
388764

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5+/m0/s1
C7H14N2O4S222.2621171601
21230620

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m1/s1
C7H14N2O4S222.2621161200
12345

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