7-[(3-azanyl-4-methyl-phenyl)carbonylamino]-8-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 7-[(3-azanyl-4-methyl-phenyl)carbonylamino]-8-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 7-[(3-amino-4-methyl-benzoyl)amino]-8-hydroxy-naphthalene-2-sulfonic acid CAS Name: 7-[[(3-amino-4-methylphenyl)-oxomethyl]amino]-8-hydroxy-2-naphthalenesulfonic acid IUPAC Name: 7-[(3-amino-4-methylbenzoyl)amino]-8-hydroxynaphthalene-2-sulfonic acid Traditional Name: 7-[(3-amino-4-methyl-benzoyl)amino]-8-hydroxy-naphthalene-2-sulfonic acid Formula: C18H16N2O5S MolecularWeight: 372.39504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(C=CC(=C3)S(=O)(=O)O)C=C2)O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(C=CC(=C3)S(=O)(=O)O)C=C2)O)N

InChI

InChI=1S/C18H16N2O5S/c1-10-2-3-12(8-15(10)19)18(22)20-16-7-5-11-4-6-13(26(23,24)25)9-14(11)17(16)21/h2-9,21H,19H2,1H3,(H,20,22)(H,23,24,25)