4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl-methyl-amino]-2,2-diphenyl-butanenitrile

Systemtic Name: 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl-methyl-amino]-2,2-diphenyl-butanenitrile Openeye Name: 4-[2-(2,3-dihydrobenzofuran-5-yl)ethyl-methyl-amino]-2,2-diphenyl-butanenitrile CAS Name: 4-[2-(2,3-dihydrobenzofuran-5-yl)ethyl-methylamino]-2,2-diphenylbutanenitrile IUPAC Name: 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl-methylamino]-2,2-diphenylbutanenitrile Traditional Name: 4-[2-coumaran-5-ylethyl(methyl)amino]-2,2-diphenyl-butyronitrile Formula: C27H28N2O MolecularWeight: 396.52402

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC2=C(C=C1)OCC2)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CCC1=CC2=C(C=C1)OCC2)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O/c1-29(17-14-22-12-13-26-23(20-22)15-19-30-26)18-16-27(21-28,24-8-4-2-5-9-24)25-10-6-3-7-11-25/h2-13,20H,14-19H2,1H3