10-[(8-oxidanyl-3,6-disulfo-naphthalen-1-yl)amino]-10-oxidanylidene-decanoic acid

Systemtic Name: 10-[(8-oxidanyl-3,6-disulfo-naphthalen-1-yl)amino]-10-oxidanylidene-decanoic acid Openeye Name: 10-[(8-hydroxy-3,6-disulfo-1-naphthyl)amino]-10-oxo-decanoic acid CAS Name: 10-[(8-hydroxy-3,6-disulfo-1-naphthalenyl)amino]-10-oxodecanoic acid IUPAC Name: 10-[(8-hydroxy-3,6-disulfonaphthalen-1-yl)amino]-10-oxodecanoic acid Traditional Name: 10-[(8-hydroxy-3,6-disulfo-1-naphthyl)amino]-10-keto-capric acid Formula: C20H25NO10S2 MolecularWeight: 503.5432

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)NC(=O)CCCCCCCCC(=O)O)O)S(=O)(=O)O

Isomeric SMILES

C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)NC(=O)CCCCCCCCC(=O)O)O)S(=O)(=O)O

InChI

InChI=1S/C20H25NO10S2/c22-17-12-15(33(29,30)31)10-13-9-14(32(26,27)28)11-16(20(13)17)21-18(23)7-5-3-1-2-4-6-8-19(24)25/h9-12,22H,1-8H2,(H,21,23)(H,24,25)(H,26,27,28)(H,29,30,31)