4-(chloromethyl)-5-oxidanylidene-1,4-benzoxazepine-3-carbonitrile

Systemtic Name: 4-(chloromethyl)-5-oxidanylidene-1,4-benzoxazepine-3-carbonitrile Openeye Name: 4-(chloromethyl)-5-oxo-1,4-benzoxazepine-3-carbonitrile CAS Name: 4-(chloromethyl)-5-oxo-1,4-benzoxazepine-3-carbonitrile IUPAC Name: 4-(chloromethyl)-5-oxo-1,4-benzoxazepine-3-carbonitrile Traditional Name: 4-(chloromethyl)-5-keto-1,4-benzoxazepine-3-carbonitrile Formula: C11H7ClN2O2 MolecularWeight: 234.63848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=CO2)C#N)CCl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=CO2)C#N)CCl

InChI

InChI=1S/C11H7ClN2O2/c12-7-14-8(5-13)6-16-10-4-2-1-3-9(10)11(14)15/h1-4,6H,7H2