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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C23H29N3O5S/c1-3-13-24(17-19-7-5-4-6-8-19)23(27)20-11-14-25(15-12-20)32(30,31)22-16-21(26(28)29)10-9-18(22)2/h4-10,16,20H,3,11-15,17H2,1-2H3