7-[(2-acetamido-4-azanyl-phenyl)diazenyl]-3-methyl-naphthalene-1-sulfonic acid

Systemtic Name: 7-[(2-acetamido-4-azanyl-phenyl)diazenyl]-3-methyl-naphthalene-1-sulfonic acid Openeye Name: 7-(2-acetamido-4-amino-phenyl)azo-3-methyl-naphthalene-1-sulfonic acid CAS Name: 7-(2-acetamido-4-aminophenyl)azo-3-methyl-1-naphthalenesulfonic acid IUPAC Name: 7-[(2-acetamido-4-aminophenyl)diazenyl]-3-methylnaphthalene-1-sulfonic acid Traditional Name: 7-(2-acetamido-4-amino-phenyl)azo-3-methyl-naphthalene-1-sulfonic acid Formula: C19H18N4O4S MolecularWeight: 398.43562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C=CC2=C1)N=NC3=C(C=C(C=C3)N)NC(=O)C)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C2C=C(C=CC2=C1)N=NC3=C(C=C(C=C3)N)NC(=O)C)S(=O)(=O)O

InChI

InChI=1S/C19H18N4O4S/c1-11-7-13-3-5-15(10-16(13)19(8-11)28(25,26)27)22-23-17-6-4-14(20)9-18(17)21-12(2)24/h3-10H,20H2,1-2H3,(H,21,24)(H,25,26,27)