2-oxidanylidene-3-[(2R)-1-phenylpropan-2-yl]imino-azepane-4-carbonitrile

Systemtic Name: 2-oxidanylidene-3-[(2R)-1-phenylpropan-2-yl]imino-azepane-4-carbonitrile Openeye Name: 3-[(1R)-1-methyl-2-phenyl-ethyl]imino-2-oxo-azepane-4-carbonitrile CAS Name: 2-oxo-3-[(2R)-1-phenylpropan-2-yl]imino-4-azepanecarbonitrile IUPAC Name: 2-oxo-3-[(2R)-1-phenylpropan-2-yl]iminoazepane-4-carbonitrile Traditional Name: 2-keto-3-[(1R)-1-methyl-2-phenyl-ethyl]imino-azepane-4-carbonitrile Formula: C16H19N3O MolecularWeight: 269.34156

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)N=C2C(CCCNC2=O)C#N

Isomeric SMILES

C[C@H](CC1=CC=CC=C1)N=C2C(CCCNC2=O)C#N

InChI

InChI=1S/C16H19N3O/c1-12(10-13-6-3-2-4-7-13)19-15-14(11-17)8-5-9-18-16(15)20/h2-4,6-7,12,14H,5,8-10H2,1H3,(H,18,20)/t12-,14?/m1/s1