7-[[2-acetamido-4-(methylamino)phenyl]diazenyl]-5-methyl-naphthalene-1-sulfonic acid

Systemtic Name: 7-[[2-acetamido-4-(methylamino)phenyl]diazenyl]-5-methyl-naphthalene-1-sulfonic acid Openeye Name: 7-[2-acetamido-4-(methylamino)phenyl]azo-5-methyl-naphthalene-1-sulfonic acid CAS Name: 7-[2-acetamido-4-(methylamino)phenyl]azo-5-methyl-1-naphthalenesulfonic acid IUPAC Name: 7-[[2-acetamido-4-(methylamino)phenyl]diazenyl]-5-methylnaphthalene-1-sulfonic acid Traditional Name: 7-[2-acetamido-4-(methylamino)phenyl]azo-5-methyl-naphthalene-1-sulfonic acid Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=C(C2=CC(=C1)N=NC3=C(C=C(C=C3)NC)NC(=O)C)S(=O)(=O)O

Isomeric SMILES

CC1=C2C=CC=C(C2=CC(=C1)N=NC3=C(C=C(C=C3)NC)NC(=O)C)S(=O)(=O)O

InChI

InChI=1S/C20H20N4O4S/c1-12-9-15(10-17-16(12)5-4-6-20(17)29(26,27)28)23-24-18-8-7-14(21-3)11-19(18)22-13(2)25/h4-11,21H,1-3H3,(H,22,25)(H,26,27,28)