(3S)-1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(3-chloro-4-methoxy-phenyl)sulfonyl-N-(4-isopropylphenyl)piperidine-3-carboxamide CAS Name: (3S)-1-(3-chloro-4-methoxyphenyl)sulfonyl-N-(4-propan-2-ylphenyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(3-chloro-4-methoxyphenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(3-chloro-4-methoxy-phenyl)sulfonyl-N-p-cumenyl-nipecotamide Formula: C22H27ClN2O4S MolecularWeight: 450.97878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C22H27ClN2O4S/c1-15(2)16-6-8-18(9-7-16)24-22(26)17-5-4-12-25(14-17)30(27,28)19-10-11-21(29-3)20(23)13-19/h6-11,13,15,17H,4-5,12,14H2,1-3H3,(H,24,26)/t17-/m0/s1