1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N-[1-(phenylmethyl)piperidin-4-yl]piperidine-3-carboxamide

Systemtic Name: 1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N-[1-(phenylmethyl)piperidin-4-yl]piperidine-3-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-1-(3-chloro-4-methoxy-phenyl)sulfonyl-piperidine-3-carboxamide CAS Name: 1-(3-chloro-4-methoxyphenyl)sulfonyl-N-[1-(phenylmethyl)-4-piperidinyl]-3-piperidinecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-1-(3-chloro-4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-1-(3-chloro-4-methoxy-phenyl)sulfonyl-nipecotamide Formula: C25H32ClN3O4S MolecularWeight: 506.05728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H32ClN3O4S/c1-33-24-10-9-22(16-23(24)26)34(31,32)29-13-5-8-20(18-29)25(30)27-21-11-14-28(15-12-21)17-19-6-3-2-4-7-19/h2-4,6-7,9-10,16,20-21H,5,8,11-15,17-18H2,1H3,(H,27,30)