2-[[2,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[2,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]methyl]benzenecarbonitrile Openeye Name: 2-[(2,8-dichloro-4-oxo-quinazolin-3-yl)methyl]benzonitrile CAS Name: 2-[(2,8-dichloro-4-oxo-3-quinazolinyl)methyl]benzonitrile IUPAC Name: 2-[(2,8-dichloro-4-oxoquinazolin-3-yl)methyl]benzonitrile Traditional Name: 2-[(2,8-dichloro-4-keto-quinazolin-3-yl)methyl]benzonitrile Formula: C16H9Cl2N3O MolecularWeight: 330.16816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C3=C(C(=CC=C3)Cl)N=C2Cl)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C3=C(C(=CC=C3)Cl)N=C2Cl)C#N

InChI

InChI=1S/C16H9Cl2N3O/c17-13-7-3-6-12-14(13)20-16(18)21(15(12)22)9-11-5-2-1-4-10(11)8-19/h1-7H,9H2