N-cyclohexyl-N-methyl-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-cyclohexyl-N-methyl-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-nitro-anilino]-N-cyclohexyl-N-methyl-acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-cyclohexyl-N-methylacetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-cyclohexyl-N-methylacetamide Traditional Name: 2-(N-besyl-3-nitro-anilino)-N-cyclohexyl-N-methyl-acetamide Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C1CCCCC1)C(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O5S/c1-22(17-9-4-2-5-10-17)21(25)16-23(18-11-8-12-19(15-18)24(26)27)30(28,29)20-13-6-3-7-14-20/h3,6-8,11-15,17H,2,4-5,9-10,16H2,1H3