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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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Single/Multi-component
Isotopically Labeled
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Found 3 results

Search term: 16071-86-6 (Found by approved synonym)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
35293744

Charge

Double-bond stereo
InChI=1/C31H22N6O9S.Cu.2Na/c38-24-14-12-21(16-22(24)31(42)43)34-32-19-8-4-17(5-9-19)18-6-10-20(11-7-18)33-37-29-26(40)15-13-23(30(29)41)35-36-28-25(39)2-1-3-27(28)47(44,45)46;;;/h1-16,38-41H,(H,42,43)(H,44,45,46);;;/q;+2;2*+1/p-4/b34-32+,36-35+,37-33+;;;/rC31H20CuN6O9S.2Na/c39-24-2-1-3-27(48(43,44)45)28(24)37-36-23-13-14-25(40)29(30(23)41)38-34-20-10-6-18(7-11-20)17-4-8-19(9-5-17)33-35-21-12-15-26-22(16-21)31(42)47-32-46-26;;/h1-16,39-41H,(H,43,44,45);;/q;2*+1/p-2/b35-33+,37-36+,38-34+;;
C31H18CuN6Na2O9S760.1101200
17215001

Charge

Double-bond stereo
InChI=1/C31H22N6O9S.Cu.2Na/c38-26-12-9-21(15-23(26)31(42)43)34-32-19-5-1-17(2-6-19)18-3-7-20(8-4-18)33-37-29-28(40)14-11-24(30(29)41)35-36-25-16-22(47(44,45)46)10-13-27(25)39;;;/h1-16,38-41H,(H,42,43)(H,44,45,46);;;/q;+2;2*+1/p-4/b34-32?,36-35+,37-33?;;;
C31H18CuN6Na2O9S760.12400
21160451

Charge

Double-bond stereo
InChI=1/C31H22N6O9S.Cu.2Na/c38-26-12-9-21(15-23(26)31(42)43)34-32-19-5-1-17(2-6-19)18-3-7-20(8-4-18)33-37-29-28(40)14-11-24(30(29)41)35-36-25-16-22(47(44,45)46)10-13-27(25)39;;;/h1-16,38-41H,(H,42,43)(H,44,45,46);;;/q;+2;2*+1/p-4
C31H18CuN6Na2O9S760.11100

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