3-[(3-azanyl-4-methyl-phenyl)carbonylamino]-4-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 3-[(3-azanyl-4-methyl-phenyl)carbonylamino]-4-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 3-[(3-amino-4-methyl-benzoyl)amino]-4-hydroxy-naphthalene-1-sulfonic acid CAS Name: 3-[[(3-amino-4-methylphenyl)-oxomethyl]amino]-4-hydroxy-1-naphthalenesulfonic acid IUPAC Name: 3-[(3-amino-4-methylbenzoyl)amino]-4-hydroxynaphthalene-1-sulfonic acid Traditional Name: 3-[(3-amino-4-methyl-benzoyl)amino]-4-hydroxy-naphthalene-1-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=CC=CC=C3C(=C2)S(=O)(=O)O)O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C3=CC=CC=C3C(=C2)S(=O)(=O)O)O)N

InChI

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