5-[1-(2,3-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-4-propan-2-yl-3,4-dihydroisoquinolin-1-yl]pentanenitrile

Systemtic Name: 5-[1-(2,3-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-4-propan-2-yl-3,4-dihydroisoquinolin-1-yl]pentanenitrile Openeye Name: 5-[1-(2,3-dimethoxyphenyl)-4-isopropyl-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-yl]pentanenitrile CAS Name: 5-[1-(2,3-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-4-propan-2-yl-3,4-dihydroisoquinolin-1-yl]pentanenitrile IUPAC Name: 5-[1-(2,3-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-4-propan-2-yl-3,4-dihydroisoquinolin-1-yl]pentanenitrile Traditional Name: 5-[1-(2,3-dimethoxyphenyl)-4-isopropyl-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-yl]valeronitrile Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(C(C2=CC(=C(C=C12)OC)OC)(CCCCC#N)C3=C(C(=CC=C3)OC)OC)C

Isomeric SMILES

CC(C)C1CN(C(C2=CC(=C(C=C12)OC)OC)(CCCCC#N)C3=C(C(=CC=C3)OC)OC)C

InChI

InChI=1S/C28H38N2O4/c1-19(2)21-18-30(3)28(14-9-8-10-15-29,22-12-11-13-24(31-4)27(22)34-7)23-17-26(33-6)25(32-5)16-20(21)23/h11-13,16-17,19,21H,8-10,14,18H2,1-7H3