1-(4-methoxy-3-methyl-phenyl)sulfonyl-N-(2-methyl-3-nitro-phenyl)piperidine-3-carboxamide

Systemtic Name: 1-(4-methoxy-3-methyl-phenyl)sulfonyl-N-(2-methyl-3-nitro-phenyl)piperidine-3-carboxamide Openeye Name: 1-(4-methoxy-3-methyl-phenyl)sulfonyl-N-(2-methyl-3-nitro-phenyl)piperidine-3-carboxamide CAS Name: 1-(4-methoxy-3-methylphenyl)sulfonyl-N-(2-methyl-3-nitrophenyl)-3-piperidinecarboxamide IUPAC Name: 1-(4-methoxy-3-methylphenyl)sulfonyl-N-(2-methyl-3-nitrophenyl)piperidine-3-carboxamide Traditional Name: 1-(4-methoxy-3-methyl-phenyl)sulfonyl-N-(2-methyl-3-nitro-phenyl)nipecotamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C)OC

InChI

InChI=1S/C21H25N3O6S/c1-14-12-17(9-10-20(14)30-3)31(28,29)23-11-5-6-16(13-23)21(25)22-18-7-4-8-19(15(18)2)24(26)27/h4,7-10,12,16H,5-6,11,13H2,1-3H3,(H,22,25)