3-[(3-aminophenyl)carbonylamino]-5-oxidanyl-naphthalene-2,7-disulfonic acid

Systemtic Name: 3-[(3-aminophenyl)carbonylamino]-5-oxidanyl-naphthalene-2,7-disulfonic acid Openeye Name: 3-[(3-aminobenzoyl)amino]-5-hydroxy-naphthalene-2,7-disulfonic acid CAS Name: 3-[[(3-aminophenyl)-oxomethyl]amino]-5-hydroxynaphthalene-2,7-disulfonic acid IUPAC Name: 3-[(3-aminobenzoyl)amino]-5-hydroxynaphthalene-2,7-disulfonic acid Traditional Name: 3-[(3-aminobenzoyl)amino]-5-hydroxy-naphthalene-2,7-disulfonic acid Formula: C17H14N2O8S2 MolecularWeight: 438.43166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)C(=O)NC2=C(C=C3C=C(C=C(C3=C2)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N)C(=O)NC2=C(C=C3C=C(C=C(C3=C2)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C17H14N2O8S2/c18-11-3-1-2-9(4-11)17(21)19-14-8-13-10(6-16(14)29(25,26)27)5-12(7-15(13)20)28(22,23)24/h1-8,20H,18H2,(H,19,21)(H,22,23,24)(H,25,26,27)