3-[2-(3-methoxyphenyl)ethyl-methyl-amino]-2,2-diphenyl-pentanenitrile

Systemtic Name: 3-[2-(3-methoxyphenyl)ethyl-methyl-amino]-2,2-diphenyl-pentanenitrile Openeye Name: 3-[2-(3-methoxyphenyl)ethyl-methyl-amino]-2,2-diphenyl-pentanenitrile CAS Name: 3-[2-(3-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanenitrile IUPAC Name: 3-[2-(3-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanenitrile Traditional Name: 3-[2-(3-methoxyphenyl)ethyl-methyl-amino]-2,2-diphenyl-valeronitrile Formula: C27H30N2O MolecularWeight: 398.5399

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)N(C)CCC3=CC(=CC=C3)OC

Isomeric SMILES

CCC(C(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)N(C)CCC3=CC(=CC=C3)OC

InChI

InChI=1S/C27H30N2O/c1-4-26(29(2)19-18-22-12-11-17-25(20-22)30-3)27(21-28,23-13-7-5-8-14-23)24-15-9-6-10-16-24/h5-17,20,26H,4,18-19H2,1-3H3