(3R)-1-(4-methoxyphenyl)sulfonyl-N-(3-oxidanylidene-3-phenylazanyl-propyl)piperidine-3-carboxamide

Systemtic Name: (3R)-1-(4-methoxyphenyl)sulfonyl-N-(3-oxidanylidene-3-phenylazanyl-propyl)piperidine-3-carboxamide Openeye Name: (3R)-N-(3-anilino-3-oxo-propyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3R)-N-(3-anilino-3-oxopropyl)-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-(3-anilino-3-oxopropyl)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-(3-anilino-3-keto-propyl)-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCC(=O)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)NCCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O5S/c1-30-19-9-11-20(12-10-19)31(28,29)25-15-5-6-17(16-25)22(27)23-14-13-21(26)24-18-7-3-2-4-8-18/h2-4,7-12,17H,5-6,13-16H2,1H3,(H,23,27)(H,24,26)/t17-/m1/s1