N-[(2R)-2-benzamidocyclohexyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C26H33N3O5S MolecularWeight: 499.62232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3CCCCC3NC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3CCCC[C@H]3NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H33N3O5S/c1-34-21-13-15-22(16-14-21)35(32,33)29-17-7-10-20(18-29)26(31)28-24-12-6-5-11-23(24)27-25(30)19-8-3-2-4-9-19/h2-4,8-9,13-16,20,23-24H,5-7,10-12,17-18H2,1H3,(H,27,30)(H,28,31)/t20?,23-,24?/m1/s1