2-[3,4-bis(bromanyl)phenyl]-2-cyclopropyl-5-[ethyl-(phenylmethyl)amino]pentanenitrile

Systemtic Name: 2-[3,4-bis(bromanyl)phenyl]-2-cyclopropyl-5-[ethyl-(phenylmethyl)amino]pentanenitrile Openeye Name: 5-[benzyl(ethyl)amino]-2-cyclopropyl-2-(3,4-dibromophenyl)pentanenitrile CAS Name: 2-cyclopropyl-2-(3,4-dibromophenyl)-5-[ethyl-(phenylmethyl)amino]pentanenitrile IUPAC Name: 5-[benzyl(ethyl)amino]-2-cyclopropyl-2-(3,4-dibromophenyl)pentanenitrile Traditional Name: 5-[benzyl(ethyl)amino]-2-cyclopropyl-2-(3,4-dibromophenyl)valeronitrile Formula: C23H26Br2N2 MolecularWeight: 490.27394

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC(C#N)(C1CC1)C2=CC(=C(C=C2)Br)Br)CC3=CC=CC=C3

Isomeric SMILES

CCN(CCCC(C#N)(C1CC1)C2=CC(=C(C=C2)Br)Br)CC3=CC=CC=C3

InChI

InChI=1S/C23H26Br2N2/c1-2-27(16-18-7-4-3-5-8-18)14-6-13-23(17-26,19-9-10-19)20-11-12-21(24)22(25)15-20/h3-5,7-8,11-12,15,19H,2,6,9-10,13-14,16H2,1H3