N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-1-(4-methylphenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-1-(4-methylphenyl)carbonyl-piperidine-3-carboxamide Openeye Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]-1-(4-methylbenzoyl)piperidine-3-carboxamide CAS Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridinyl]methyl]-1-[(4-methylphenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-1-(4-methylbenzoyl)piperidine-3-carboxamide Traditional Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]-1-p-toluoyl-nipecotamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NCC3=CN=C(C=C3)OC4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NCC3=CN=C(C=C3)OC4=C(C=CC(=C4)C)C

InChI

InChI=1S/C28H31N3O3/c1-19-7-11-23(12-8-19)28(33)31-14-4-5-24(18-31)27(32)30-17-22-10-13-26(29-16-22)34-25-15-20(2)6-9-21(25)3/h6-13,15-16,24H,4-5,14,17-18H2,1-3H3,(H,30,32)