4-[(4-azanyl-3-methyl-phenyl)carbonylamino]-6-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 4-[(4-azanyl-3-methyl-phenyl)carbonylamino]-6-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 4-[(4-amino-3-methyl-benzoyl)amino]-6-hydroxy-naphthalene-2-sulfonic acid CAS Name: 4-[[(4-amino-3-methylphenyl)-oxomethyl]amino]-6-hydroxy-2-naphthalenesulfonic acid IUPAC Name: 4-[(4-amino-3-methylbenzoyl)amino]-6-hydroxynaphthalene-2-sulfonic acid Traditional Name: 4-[(4-amino-3-methyl-benzoyl)amino]-6-hydroxy-naphthalene-2-sulfonic acid Formula: C18H16N2O5S MolecularWeight: 372.39504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=C3C=C(C=CC3=CC(=C2)S(=O)(=O)O)O)N

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=C3C=C(C=CC3=CC(=C2)S(=O)(=O)O)O)N

InChI

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