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

Systemtic Name: 3-[1-[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]-1,4-dihydroquinazolin-2-one Openeye Name: 3-[1-[2-(3,4-dichlorophenyl)-2-oxo-ethyl]-4-piperidyl]-1,4-dihydroquinazolin-2-one CAS Name: 3-[1-[2-(3,4-dichlorophenyl)-2-oxoethyl]-4-piperidinyl]-1,4-dihydroquinazolin-2-one IUPAC Name: 3-[1-[2-(3,4-dichlorophenyl)-2-oxoethyl]piperidin-4-yl]-1,4-dihydroquinazolin-2-one Traditional Name: 3-[1-[2-(3,4-dichlorophenyl)-2-keto-ethyl]-4-piperidyl]-1,4-dihydroquinazolin-2-one Formula: C21H21Cl2N3O2 MolecularWeight: 418.31634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21Cl2N3O2/c22-17-6-5-14(11-18(17)23)20(27)13-25-9-7-16(8-10-25)26-12-15-3-1-2-4-19(15)24-21(26)28/h1-6,11,16H,7-10,12-13H2,(H,24,28)