2-[[4-(4-methyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[4-(4-methyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[4-(2-hydroxy-4-methyl-benzoyl)piperazin-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[4-[(2-hydroxy-4-methylphenyl)-oxomethyl]-1-piperazinyl]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[4-(2-hydroxy-4-methylbenzoyl)piperazin-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[4-(2-hydroxy-4-methyl-benzoyl)piperazino]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C21H22N4O3 MolecularWeight: 378.42438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=O)N4C=CC=CC4=N3)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=O)N4C=CC=CC4=N3)O

InChI

InChI=1S/C21H22N4O3/c1-15-5-6-17(18(26)12-15)21(28)24-10-8-23(9-11-24)14-16-13-20(27)25-7-3-2-4-19(25)22-16/h2-7,12-13,26H,8-11,14H2,1H3