1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(3-chloro-4-methoxy-phenyl)sulfonyl-N-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: 1-(3-chloro-4-methoxyphenyl)sulfonyl-N-[(4-methylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(3-chloro-4-methoxyphenyl)sulfonyl-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-(3-chloro-4-methoxy-phenyl)sulfonyl-N-(4-methylbenzyl)nipecotamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H25ClN2O4S/c1-15-5-7-16(8-6-15)13-23-21(25)17-4-3-11-24(14-17)29(26,27)18-9-10-20(28-2)19(22)12-18/h5-10,12,17H,3-4,11,13-14H2,1-2H3,(H,23,25)