N-(5-chloranyl-2-phenoxy-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(5-chloranyl-2-phenoxy-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Openeye Name: N-(5-chloro-2-phenoxy-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide CAS Name: N-(5-chloro-2-phenoxyphenyl)-1-(3-phenylpropylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-phenoxyphenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Traditional Name: N-(5-chloro-2-phenoxy-phenyl)-1-(3-phenylpropylsulfonyl)nipecotamide Formula: C27H29ClN2O4S MolecularWeight: 513.04816

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)Cl)OC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)Cl)OC4=CC=CC=C4

InChI

InChI=1S/C27H29ClN2O4S/c28-23-15-16-26(34-24-13-5-2-6-14-24)25(19-23)29-27(31)22-12-7-17-30(20-22)35(32,33)18-8-11-21-9-3-1-4-10-21/h1-6,9-10,13-16,19,22H,7-8,11-12,17-18,20H2,(H,29,31)