4-[(4-azanyl-2-sulfo-phenyl)carbonylamino]naphthalene-1,6-disulfonic acid

Systemtic Name: 4-[(4-azanyl-2-sulfo-phenyl)carbonylamino]naphthalene-1,6-disulfonic acid Openeye Name: 4-[(4-amino-2-sulfo-benzoyl)amino]naphthalene-1,6-disulfonic acid CAS Name: 4-[[(4-amino-2-sulfophenyl)-oxomethyl]amino]naphthalene-1,6-disulfonic acid IUPAC Name: 4-[(4-amino-2-sulfobenzoyl)amino]naphthalene-1,6-disulfonic acid Traditional Name: 4-[(4-amino-2-sulfo-benzoyl)amino]naphthalene-1,6-disulfonic acid Formula: C17H14N2O10S3 MolecularWeight: 502.49546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)S(=O)(=O)O)C(=O)NC2=C3C=C(C=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N)S(=O)(=O)O)C(=O)NC2=C3C=C(C=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C17H14N2O10S3/c18-9-1-3-12(16(7-9)32(27,28)29)17(20)19-14-5-6-15(31(24,25)26)11-4-2-10(8-13(11)14)30(21,22)23/h1-8H,18H2,(H,19,20)(H,21,22,23)(H,24,25,26)(H,27,28,29)