2-[[4-(2,4-dimethylphenyl)carbonylpiperidin-1-yl]methyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(2,4-dimethylphenyl)carbonylpiperidin-1-yl]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[[4-(2,4-dimethylbenzoyl)-1-piperidyl]methyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[4-[(2,4-dimethylphenyl)-oxomethyl]-1-piperidinyl]methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[[4-(2,4-dimethylbenzoyl)piperidin-1-yl]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[[4-(2,4-dimethylbenzoyl)piperidino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)C2CCN(CC2)CC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)C2CCN(CC2)CC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC)C

InChI

InChI=1S/C25H29N3O4/c1-15-5-6-18(16(2)11-15)24(29)17-7-9-28(10-8-17)14-23-26-20-13-22(32-4)21(31-3)12-19(20)25(30)27-23/h5-6,11-13,17H,7-10,14H2,1-4H3,(H,26,27,30)