N-[(E)-[(4-methylphenyl)sulfonyl-(phenylsulfonyl)methylidene]amino]-4-nitro-aniline

Systemtic Name: N-[(E)-[(4-methylphenyl)sulfonyl-(phenylsulfonyl)methylidene]amino]-4-nitro-aniline Openeye Name: N-[(E)-[benzenesulfonyl(p-tolylsulfonyl)methylene]amino]-4-nitro-aniline CAS Name: N-[(E)-[benzenesulfonyl-(4-methylphenyl)sulfonylmethylidene]amino]-4-nitroaniline IUPAC Name: N-[(E)-[benzenesulfonyl-(4-methylphenyl)sulfonylmethylidene]amino]-4-nitroaniline Traditional Name: [(E)-[besyl(tosyl)methylene]amino]-(4-nitrophenyl)amine Formula: C20H17N3O6S2 MolecularWeight: 459.49548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=NNC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=N/NC2=CC=C(C=C2)[N+](=O)[O-])/S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H17N3O6S2/c1-15-7-13-19(14-8-15)31(28,29)20(30(26,27)18-5-3-2-4-6-18)22-21-16-9-11-17(12-10-16)23(24)25/h2-14,21H,1H3/b22-20+