2-[methylsulfonyl-(3-nitrophenyl)amino]-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[methylsulfonyl-(3-nitrophenyl)amino]-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(N-methylsulfonyl-3-nitro-anilino)-N-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(N-methylsulfonyl-3-nitroanilino)-N-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(N-methylsulfonyl-3-nitroanilino)-N-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(N-mesyl-3-nitro-anilino)-N-(4-piperidinosulfonylphenyl)acetamide Formula: C20H24N4O7S2 MolecularWeight: 496.55716

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O7S2/c1-32(28,29)23(17-6-5-7-18(14-17)24(26)27)15-20(25)21-16-8-10-19(11-9-16)33(30,31)22-12-3-2-4-13-22/h5-11,14H,2-4,12-13,15H2,1H3,(H,21,25)