3-nitro-4-[(3-phenylazanylphenyl)amino]benzenesulfonamide

Systemtic Name: 3-nitro-4-[(3-phenylazanylphenyl)amino]benzenesulfonamide Openeye Name: 4-(3-anilinoanilino)-3-nitro-benzenesulfonamide CAS Name: 4-(3-anilinoanilino)-3-nitrobenzenesulfonamide IUPAC Name: 4-(3-anilinoanilino)-3-nitrobenzenesulfonamide Traditional Name: 4-(3-anilinoanilino)-3-nitro-benzenesulfonamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC(=CC=C2)NC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC(=CC=C2)NC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c19-27(25,26)16-9-10-17(18(12-16)22(23)24)21-15-8-4-7-14(11-15)20-13-5-2-1-3-6-13/h1-12,20-21H,(H2,19,25,26)