N-(5-chloranyl-2-cyano-phenyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]acetamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Formula: C26H24ClN3O3 MolecularWeight: 461.94006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC(=O)NC3=C(C=CC(=C3)Cl)C#N)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)CC(=O)NC3=C(C=CC(=C3)Cl)C#N)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H24ClN3O3/c1-32-23-12-18-10-11-30(16-25(31)29-22-13-20(27)9-8-19(22)15-28)26(17-6-4-3-5-7-17)21(18)14-24(23)33-2/h3-9,12-14,26H,10-11,16H2,1-2H3,(H,29,31)/t26-/m1/s1