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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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