8-(4-methylphenyl)-2-phenethyl-6-pyrrolidin-1-yl-3,4-dihydro-1H-isoquinoline-5-carbonitrile

Systemtic Name: 8-(4-methylphenyl)-2-phenethyl-6-pyrrolidin-1-yl-3,4-dihydro-1H-isoquinoline-5-carbonitrile Openeye Name: 2-phenethyl-8-(p-tolyl)-6-pyrrolidin-1-yl-3,4-dihydro-1H-isoquinoline-5-carbonitrile CAS Name: 8-(4-methylphenyl)-2-phenethyl-6-(1-pyrrolidinyl)-3,4-dihydro-1H-isoquinoline-5-carbonitrile IUPAC Name: 8-(4-methylphenyl)-2-phenethyl-6-pyrrolidin-1-yl-3,4-dihydro-1H-isoquinoline-5-carbonitrile Traditional Name: 2-phenethyl-8-(p-tolyl)-6-pyrrolidino-3,4-dihydro-1H-isoquinoline-5-carbonitrile Formula: C29H31N3 MolecularWeight: 421.57654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C3=C2CN(CC3)CCC4=CC=CC=C4)C#N)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C3=C2CN(CC3)CCC4=CC=CC=C4)C#N)N5CCCC5

InChI

InChI=1S/C29H31N3/c1-22-9-11-24(12-10-22)26-19-29(32-15-5-6-16-32)27(20-30)25-14-18-31(21-28(25)26)17-13-23-7-3-2-4-8-23/h2-4,7-12,19H,5-6,13-18,21H2,1H3