N-(5-chloranyl-2-phenoxy-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-phenoxy-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-phenoxy-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-(5-chloro-2-phenoxyphenyl)-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-phenoxyphenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(5-chloro-2-phenoxy-phenyl)-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C27H29ClN2O4S MolecularWeight: 513.04816

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3)S(=O)(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3)S(=O)(=O)CCCC4=CC=CC=C4

InChI

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