1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-(3-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-(3-nitrophenyl)piperidine-4-carboxamide Openeye Name: 1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-(3-nitrophenyl)piperidine-4-carboxamide CAS Name: 1-(2-methoxy-5-methylphenyl)sulfonyl-N-(3-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-methoxy-5-methylphenyl)sulfonyl-N-(3-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-(3-nitrophenyl)isonipecotamide Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O6S/c1-14-6-7-18(29-2)19(12-14)30(27,28)22-10-8-15(9-11-22)20(24)21-16-4-3-5-17(13-16)23(25)26/h3-7,12-13,15H,8-11H2,1-2H3,(H,21,24)