3-(4-chlorophenyl)-2,7-dimethyl-5-oxidanylidene-3,4-dihydro-1H-1,2-diazepine-6-carbonitrile

Systemtic Name: 3-(4-chlorophenyl)-2,7-dimethyl-5-oxidanylidene-3,4-dihydro-1H-1,2-diazepine-6-carbonitrile Openeye Name: 3-(4-chlorophenyl)-2,7-dimethyl-5-oxo-3,4-dihydro-1H-diazepine-6-carbonitrile CAS Name: 3-(4-chlorophenyl)-2,7-dimethyl-5-oxo-3,4-dihydro-1H-diazepine-6-carbonitrile IUPAC Name: 3-(4-chlorophenyl)-2,7-dimethyl-5-oxo-3,4-dihydro-1H-diazepine-6-carbonitrile Traditional Name: 3-(4-chlorophenyl)-5-keto-2,7-dimethyl-3,4-dihydro-1H-diazepine-6-carbonitrile Formula: C14H14ClN3O MolecularWeight: 275.73346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)CC(N(N1)C)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CC1=C(C(=O)CC(N(N1)C)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C14H14ClN3O/c1-9-12(8-16)14(19)7-13(18(2)17-9)10-3-5-11(15)6-4-10/h3-6,13,17H,7H2,1-2H3