2-[4-chloranyl-2-[3-[methyl-(phenylmethyl)amino]propyl]phenyl]-2-cyclopropyl-ethanenitrile

Systemtic Name: 2-[4-chloranyl-2-[3-[methyl-(phenylmethyl)amino]propyl]phenyl]-2-cyclopropyl-ethanenitrile Openeye Name: 2-[2-[3-[benzyl(methyl)amino]propyl]-4-chloro-phenyl]-2-cyclopropyl-acetonitrile CAS Name: 2-[4-chloro-2-[3-[methyl-(phenylmethyl)amino]propyl]phenyl]-2-cyclopropylacetonitrile IUPAC Name: 2-[2-[3-[benzyl(methyl)amino]propyl]-4-chlorophenyl]-2-cyclopropylacetonitrile Traditional Name: 2-[2-[3-[benzyl(methyl)amino]propyl]-4-chloro-phenyl]-2-cyclopropyl-acetonitrile Formula: C22H25ClN2 MolecularWeight: 352.9003

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=C(C=CC(=C1)Cl)C(C#N)C2CC2)CC3=CC=CC=C3

Isomeric SMILES

CN(CCCC1=C(C=CC(=C1)Cl)C(C#N)C2CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H25ClN2/c1-25(16-17-6-3-2-4-7-17)13-5-8-19-14-20(23)11-12-21(19)22(15-24)18-9-10-18/h2-4,6-7,11-12,14,18,22H,5,8-10,13,16H2,1H3