4-[(3-azanyl-4-methyl-phenyl)carbonylamino]-5-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 4-[(3-azanyl-4-methyl-phenyl)carbonylamino]-5-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 4-[(3-amino-4-methyl-benzoyl)amino]-5-hydroxy-naphthalene-2-sulfonic acid CAS Name: 4-[[(3-amino-4-methylphenyl)-oxomethyl]amino]-5-hydroxy-2-naphthalenesulfonic acid IUPAC Name: 4-[(3-amino-4-methylbenzoyl)amino]-5-hydroxynaphthalene-2-sulfonic acid Traditional Name: 4-[(3-amino-4-methyl-benzoyl)amino]-5-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=C3C(=CC(=C2)S(=O)(=O)O)C=CC=C3O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=CC=C3O)N

InChI

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