3-[1-[2-(3-chlorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]-1,4-dihydroquinazolin-2-one

Systemtic Name: 3-[1-[2-(3-chlorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]-1,4-dihydroquinazolin-2-one Openeye Name: 3-[1-[2-(3-chlorophenyl)-2-oxo-ethyl]-4-piperidyl]-1,4-dihydroquinazolin-2-one CAS Name: 3-[1-[2-(3-chlorophenyl)-2-oxoethyl]-4-piperidinyl]-1,4-dihydroquinazolin-2-one IUPAC Name: 3-[1-[2-(3-chlorophenyl)-2-oxoethyl]piperidin-4-yl]-1,4-dihydroquinazolin-2-one Traditional Name: 3-[1-[2-(3-chlorophenyl)-2-keto-ethyl]-4-piperidyl]-1,4-dihydroquinazolin-2-one Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CC3=CC=CC=C3NC2=O)CC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCC1N2CC3=CC=CC=C3NC2=O)CC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H22ClN3O2/c22-17-6-3-5-15(12-17)20(26)14-24-10-8-18(9-11-24)25-13-16-4-1-2-7-19(16)23-21(25)27/h1-7,12,18H,8-11,13-14H2,(H,23,27)