2-(azepan-1-yl)-2-(4-methoxyphenyl)propanenitrile

Systemtic Name: 2-(azepan-1-yl)-2-(4-methoxyphenyl)propanenitrile Openeye Name: 2-(azepan-1-yl)-2-(4-methoxyphenyl)propanenitrile CAS Name: 2-(1-azepanyl)-2-(4-methoxyphenyl)propanenitrile IUPAC Name: 2-(azepan-1-yl)-2-(4-methoxyphenyl)propanenitrile Traditional Name: 2-(azepan-1-yl)-2-(4-methoxyphenyl)propionitrile Formula: C16H22N2O MolecularWeight: 258.35868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1=CC=C(C=C1)OC)N2CCCCCC2

Isomeric SMILES

CC(C#N)(C1=CC=C(C=C1)OC)N2CCCCCC2

InChI

InChI=1S/C16H22N2O/c1-16(13-17,18-11-5-3-4-6-12-18)14-7-9-15(19-2)10-8-14/h7-10H,3-6,11-12H2,1-2H3