4-(2-oxidanylideneazepan-1-yl)carbonylbenzenecarbonitrile

Systemtic Name: 4-(2-oxidanylideneazepan-1-yl)carbonylbenzenecarbonitrile Openeye Name: 4-(2-oxoazepane-1-carbonyl)benzonitrile CAS Name: 4-[oxo-(2-oxo-1-azepanyl)methyl]benzonitrile IUPAC Name: 4-(2-oxoazepane-1-carbonyl)benzonitrile Traditional Name: 4-(2-ketoazepane-1-carbonyl)benzonitrile Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)C(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C1CCC(=O)N(CC1)C(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H14N2O2/c15-10-11-5-7-12(8-6-11)14(18)16-9-3-1-2-4-13(16)17/h5-8H,1-4,9H2