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

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-1-(3-phenylpropylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-1-(3-phenylpropylsulfonyl)nipecotamide Formula: C23H29ClN2O5S MolecularWeight: 481.00476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2CCCN(C2)S(=O)(=O)CCCC3=CC=CC=C3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2CCCN(C2)S(=O)(=O)CCCC3=CC=CC=C3)OC)Cl

InChI

InChI=1S/C23H29ClN2O5S/c1-30-21-15-20(22(31-2)14-19(21)24)25-23(27)18-11-6-12-26(16-18)32(28,29)13-7-10-17-8-4-3-5-9-17/h3-5,8-9,14-15,18H,6-7,10-13,16H2,1-2H3,(H,25,27)