N-butyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-N-phenyl-piperidine-4-carboxamide

Systemtic Name: N-butyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-N-phenyl-piperidine-4-carboxamide Openeye Name: N-butyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-N-phenyl-piperidine-4-carboxamide CAS Name: N-butyl-1-(2-methyl-5-nitrophenyl)sulfonyl-N-phenyl-4-piperidinecarboxamide IUPAC Name: N-butyl-1-(2-methyl-5-nitrophenyl)sulfonyl-N-phenylpiperidine-4-carboxamide Traditional Name: N-butyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-N-phenyl-isonipecotamide Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCCN(C1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C23H29N3O5S/c1-3-4-14-25(20-8-6-5-7-9-20)23(27)19-12-15-24(16-13-19)32(30,31)22-17-21(26(28)29)11-10-18(22)2/h5-11,17,19H,3-4,12-16H2,1-2H3