chloranylbenzene; 2-(2-oxidanylidene-2-pyridin-2-yl-ethyl)-1H-quinazolin-4-one

Systemtic Name: chloranylbenzene; 2-(2-oxidanylidene-2-pyridin-2-yl-ethyl)-1H-quinazolin-4-one Openeye Name: chlorobenzene; 2-[2-oxo-2-(2-pyridyl)ethyl]-1H-quinazolin-4-one CAS Name: chlorobenzene; 2-[2-oxo-2-(2-pyridinyl)ethyl]-1H-quinazolin-4-one IUPAC Name: chlorobenzene; 2-(2-oxo-2-pyridin-2-ylethyl)-1H-quinazolin-4-one Traditional Name: chlorobenzene; 2-[2-keto-2-(2-pyridyl)ethyl]-1H-quinazolin-4-one Formula: C21H16ClN3O2 MolecularWeight: 377.82364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)Cl.C1=CC=C2C(=C1)C(=O)N=C(N2)CC(=O)C3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)Cl.C1=CC=C2C(=C1)C(=O)N=C(N2)CC(=O)C3=CC=CC=N3

InChI

InChI=1S/C15H11N3O2.C6H5Cl/c19-13(12-7-3-4-8-16-12)9-14-17-11-6-2-1-5-10(11)15(20)18-14;7-6-4-2-1-3-5-6/h1-8H,9H2,(H,17,18,20);1-5H