7-[(4-aminophenyl)carbonylamino]naphthalene-1,3-disulfonic acid; sodium

Systemtic Name: 7-[(4-aminophenyl)carbonylamino]naphthalene-1,3-disulfonic acid; sodium Openeye Name: 7-[(4-aminobenzoyl)amino]naphthalene-1,3-disulfonic acid; sodium CAS Name: 7-[[(4-aminophenyl)-oxomethyl]amino]naphthalene-1,3-disulfonic acid; sodium IUPAC Name: 7-[(4-aminobenzoyl)amino]naphthalene-1,3-disulfonic acid; sodium Traditional Name: 7-[(4-aminobenzoyl)amino]naphthalene-1,3-disulfonic acid; sodium Formula: C17H14N2NaO7S2 MolecularWeight: 445.42203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O)N.[Na]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O)N.[Na]

InChI

InChI=1S/C17H14N2O7S2.Na/c18-12-4-1-10(2-5-12)17(20)19-13-6-3-11-7-14(27(21,22)23)9-16(15(11)8-13)28(24,25)26;/h1-9H,18H2,(H,19,20)(H,21,22,23)(H,24,25,26);