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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[(4-methoxyphenyl)methyl]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: N-[(4-methoxyphenyl)methyl]-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-p-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=C(C=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O4S/c1-16-5-11-20(12-6-16)28(25,26)23-13-3-4-18(15-23)21(24)22-14-17-7-9-19(27-2)10-8-17/h5-12,18H,3-4,13-15H2,1-2H3,(H,22,24)