(3R)-N-[(3-methoxyphenyl)methyl]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-[(3-methoxyphenyl)methyl]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-[(3-methoxyphenyl)methyl]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3R)-N-[(3-methoxyphenyl)methyl]-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-[(3-methoxyphenyl)methyl]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-m-anisyl-1-tosyl-nipecotamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H26N2O4S/c1-16-8-10-20(11-9-16)28(25,26)23-12-4-6-18(15-23)21(24)22-14-17-5-3-7-19(13-17)27-2/h3,5,7-11,13,18H,4,6,12,14-15H2,1-2H3,(H,22,24)/t18-/m1/s1