2-[2-(1,4-diazepan-1-yl)ethyl]-3-methyl-2-phenyl-pentanenitrile

Systemtic Name: 2-[2-(1,4-diazepan-1-yl)ethyl]-3-methyl-2-phenyl-pentanenitrile Openeye Name: 2-[2-(1,4-diazepan-1-yl)ethyl]-3-methyl-2-phenyl-pentanenitrile CAS Name: 2-[2-(1,4-diazepan-1-yl)ethyl]-3-methyl-2-phenylpentanenitrile IUPAC Name: 2-[2-(1,4-diazepan-1-yl)ethyl]-3-methyl-2-phenylpentanenitrile Traditional Name: 2-[2-(1,4-diazepan-1-yl)ethyl]-3-methyl-2-phenyl-valeronitrile Formula: C19H29N3 MolecularWeight: 299.45366

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CCN1CCCNCC1)(C#N)C2=CC=CC=C2

Isomeric SMILES

CCC(C)C(CCN1CCCNCC1)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C19H29N3/c1-3-17(2)19(16-20,18-8-5-4-6-9-18)10-14-22-13-7-11-21-12-15-22/h4-6,8-9,17,21H,3,7,10-15H2,1-2H3