N-(2-methyl-4-morpholin-4-yl-phenyl)-1-(4-methylphenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-(2-methyl-4-morpholin-4-yl-phenyl)-1-(4-methylphenyl)carbonyl-piperidine-3-carboxamide Openeye Name: 1-(4-methylbenzoyl)-N-(2-methyl-4-morpholino-phenyl)piperidine-3-carboxamide CAS Name: N-[2-methyl-4-(4-morpholinyl)phenyl]-1-[(4-methylphenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-methylbenzoyl)-N-(2-methyl-4-morpholin-4-ylphenyl)piperidine-3-carboxamide Traditional Name: N-(2-methyl-4-morpholino-phenyl)-1-p-toluoyl-nipecotamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=C(C=C(C=C3)N4CCOCC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=C(C=C(C=C3)N4CCOCC4)C

InChI

InChI=1S/C25H31N3O3/c1-18-5-7-20(8-6-18)25(30)28-11-3-4-21(17-28)24(29)26-23-10-9-22(16-19(23)2)27-12-14-31-15-13-27/h5-10,16,21H,3-4,11-15,17H2,1-2H3,(H,26,29)