3-[2-(chloromethyl)phenyl]carbonyl-4H-quinazoline-4-carbonitrile

Systemtic Name: 3-[2-(chloromethyl)phenyl]carbonyl-4H-quinazoline-4-carbonitrile Openeye Name: 3-[2-(chloromethyl)benzoyl]-4H-quinazoline-4-carbonitrile CAS Name: 3-[[2-(chloromethyl)phenyl]-oxomethyl]-4H-quinazoline-4-carbonitrile IUPAC Name: 3-[2-(chloromethyl)benzoyl]-4H-quinazoline-4-carbonitrile Traditional Name: 3-[2-(chloromethyl)benzoyl]-4H-quinazoline-4-carbonitrile Formula: C17H12ClN3O MolecularWeight: 309.74968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCl)C(=O)N2C=NC3=CC=CC=C3C2C#N

Isomeric SMILES

C1=CC=C(C(=C1)CCl)C(=O)N2C=NC3=CC=CC=C3C2C#N

InChI

InChI=1S/C17H12ClN3O/c18-9-12-5-1-2-6-13(12)17(22)21-11-20-15-8-4-3-7-14(15)16(21)10-19/h1-8,11,16H,9H2