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
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 5 results

Search term: VDCAVQHFHCNMJY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
574900

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H21NO5/c1-3-4-11(15(19)20)7-10-14(18)17-13-8-5-12(6-9-13)16(21)22-2/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,17,18)(H,19,20)
C16H21NO5307.3416171200
1506023

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H21NO5/c1-3-4-11(15(19)20)7-10-14(18)17-13-8-5-12(6-9-13)16(21)22-2/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,17,18)(H,19,20)/t11-/m1/s1
C16H21NO5307.34164300
1506021

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H21NO5/c1-3-4-11(15(19)20)7-10-14(18)17-13-8-5-12(6-9-13)16(21)22-2/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,17,18)(H,19,20)/t11-/m0/s1
C16H21NO5307.34162100
1506022

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H21NO5/c1-3-4-11(15(19)20)7-10-14(18)17-13-8-5-12(6-9-13)16(21)22-2/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,17,18)(H,19,20)/p-1/t11-/m1/s1
C16H20NO5306.33421100
1506020

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H21NO5/c1-3-4-11(15(19)20)7-10-14(18)17-13-8-5-12(6-9-13)16(21)22-2/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,17,18)(H,19,20)/p-1/t11-/m0/s1
C16H20NO5306.33421100

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