7-oxidanylidene-6-[(phenylmethyl)amino]-1,2,3,4-tetrahydroazepine-5-carbonitrile

Systemtic Name: 7-oxidanylidene-6-[(phenylmethyl)amino]-1,2,3,4-tetrahydroazepine-5-carbonitrile Openeye Name: 6-(benzylamino)-7-oxo-1,2,3,4-tetrahydroazepine-5-carbonitrile CAS Name: 7-oxo-6-[(phenylmethyl)amino]-1,2,3,4-tetrahydroazepine-5-carbonitrile IUPAC Name: 6-(benzylamino)-7-oxo-1,2,3,4-tetrahydroazepine-5-carbonitrile Traditional Name: 6-(benzylamino)-7-keto-1,2,3,4-tetrahydroazepine-5-carbonitrile Formula: C14H15N3O MolecularWeight: 241.2884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C(=O)NC1)NCC2=CC=CC=C2)C#N

Isomeric SMILES

C1CC(=C(C(=O)NC1)NCC2=CC=CC=C2)C#N

InChI

InChI=1S/C14H15N3O/c15-9-12-7-4-8-16-14(18)13(12)17-10-11-5-2-1-3-6-11/h1-3,5-6,17H,4,7-8,10H2,(H,16,18)