2-[2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrrol-1-yl]benzenecarbonitrile

Systemtic Name: 2-[2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrrol-1-yl]benzenecarbonitrile Openeye Name: 2-[2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrrol-1-yl]benzonitrile CAS Name: 2-[2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1-pyrrolyl]benzonitrile IUPAC Name: 2-[2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrrol-1-yl]benzonitrile Traditional Name: 2-[2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyrrol-1-yl]benzonitrile Formula: C23H23N3O2 MolecularWeight: 373.44762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC3=CC=CN3C4=CC=CC=C4C#N)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC3=CC=CN3C4=CC=CC=C4C#N)OC

InChI

InChI=1S/C23H23N3O2/c1-27-22-12-17-9-11-25(15-19(17)13-23(22)28-2)16-20-7-5-10-26(20)21-8-4-3-6-18(21)14-24/h3-8,10,12-13H,9,11,15-16H2,1-2H3