2-[2-(1-chloroethyl)-4-oxidanylidene-quinazolin-3-yl]ethanenitrile

Systemtic Name: 2-[2-(1-chloroethyl)-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-(1-chloroethyl)-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-(1-chloroethyl)-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-(1-chloroethyl)-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[2-(1-chloroethyl)-4-keto-quinazolin-3-yl]acetonitrile Formula: C12H10ClN3O MolecularWeight: 247.6803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=O)N1CC#N)Cl

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=O)N1CC#N)Cl

InChI

InChI=1S/C12H10ClN3O/c1-8(13)11-15-10-5-3-2-4-9(10)12(17)16(11)7-6-14/h2-5,8H,7H2,1H3