[3-[[4-(2-oxidanylidene-4-phenyl-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]methyl]phenyl] ethanoate

Systemtic Name: [3-[[4-(2-oxidanylidene-4-phenyl-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]methyl]phenyl] ethanoate Openeye Name: [3-[[4-(2-oxo-4-phenyl-1,4-dihydroquinazolin-3-yl)-1-piperidyl]methyl]phenyl] acetate CAS Name: acetic acid [3-[[4-(2-oxo-4-phenyl-1,4-dihydroquinazolin-3-yl)-1-piperidinyl]methyl]phenyl] ester IUPAC Name: [3-[[4-(2-oxo-4-phenyl-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]methyl]phenyl] acetate Traditional Name: acetic acid [3-[[4-(2-keto-4-phenyl-1,4-dihydroquinazolin-3-yl)piperidino]methyl]phenyl] ester Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)CN2CCC(CC2)N3C(C4=CC=CC=C4NC3=O)C5=CC=CC=C5

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)CN2CCC(CC2)N3C(C4=CC=CC=C4NC3=O)C5=CC=CC=C5

InChI

InChI=1S/C28H29N3O3/c1-20(32)34-24-11-7-8-21(18-24)19-30-16-14-23(15-17-30)31-27(22-9-3-2-4-10-22)25-12-5-6-13-26(25)29-28(31)33/h2-13,18,23,27H,14-17,19H2,1H3,(H,29,33)