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

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-(2-methoxy-4-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(2-methoxy-4-nitrophenyl)sulfonyl-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(2-methoxy-4-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-benzyl-1-(2-methoxy-4-nitro-phenyl)sulfonyl-isonipecotamide Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O6S/c1-29-18-13-17(23(25)26)7-8-19(18)30(27,28)22-11-9-16(10-12-22)20(24)21-14-15-5-3-2-4-6-15/h2-8,13,16H,9-12,14H2,1H3,(H,21,24)