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

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)sulfonyl-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-(2-methoxy-4-nitro-phenyl)sulfonyl-N-phenyl-piperidine-3-carboxamide CAS Name: 1-(2-methoxy-4-nitrophenyl)sulfonyl-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-(2-methoxy-4-nitrophenyl)sulfonyl-N-phenylpiperidine-3-carboxamide Traditional Name: 1-(2-methoxy-4-nitro-phenyl)sulfonyl-N-phenyl-nipecotamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C19H21N3O6S/c1-28-17-12-16(22(24)25)9-10-18(17)29(26,27)21-11-5-6-14(13-21)19(23)20-15-7-3-2-4-8-15/h2-4,7-10,12,14H,5-6,11,13H2,1H3,(H,20,23)