4-bromanyl-5-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-2-phenyl-pentanenitrile

Systemtic Name: 4-bromanyl-5-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-2-phenyl-pentanenitrile Openeye Name: 5-[benzyl-[(3-methoxyphenyl)methyl]amino]-4-bromo-2-phenyl-pentanenitrile CAS Name: 4-bromo-5-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-2-phenylpentanenitrile IUPAC Name: 5-[benzyl-[(3-methoxyphenyl)methyl]amino]-4-bromo-2-phenylpentanenitrile Traditional Name: 5-[benzyl(m-anisyl)amino]-4-bromo-2-phenyl-valeronitrile Formula: C26H27BrN2O MolecularWeight: 463.40938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CC2=CC=CC=C2)CC(CC(C#N)C3=CC=CC=C3)Br

Isomeric SMILES

COC1=CC=CC(=C1)CN(CC2=CC=CC=C2)CC(CC(C#N)C3=CC=CC=C3)Br

InChI

InChI=1S/C26H27BrN2O/c1-30-26-14-8-11-22(15-26)19-29(18-21-9-4-2-5-10-21)20-25(27)16-24(17-28)23-12-6-3-7-13-23/h2-15,24-25H,16,18-20H2,1H3