(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 1-(4-chlorophenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: (7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 1-(4-chlorophenyl)carbonylpiperidine-3-carboxylate Openeye Name: (7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 1-(4-chlorobenzoyl)piperidine-3-carboxylate CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-3-piperidinecarboxylic acid (7-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 1-(4-chlorobenzoyl)piperidine-3-carboxylate Traditional Name: 1-(4-chlorobenzoyl)nipecotic acid (4-keto-7-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C23H22ClN3O4 MolecularWeight: 439.89148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)COC(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)Cl)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)COC(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)Cl)C=C1

InChI

InChI=1S/C23H22ClN3O4/c1-15-4-9-20-25-19(11-21(28)27(20)12-15)14-31-23(30)17-3-2-10-26(13-17)22(29)16-5-7-18(24)8-6-16/h4-9,11-12,17H,2-3,10,13-14H2,1H3