(2R)-N-(1-cyanocyclohexyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propanamide

Systemtic Name: (2R)-N-(1-cyanocyclohexyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propanamide Openeye Name: (2R)-N-(1-cyanocyclohexyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propanamide CAS Name: (2R)-N-(1-cyanocyclohexyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propanamide IUPAC Name: (2R)-N-(1-cyanocyclohexyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propanamide Traditional Name: (2R)-N-(1-cyanocyclohexyl)-2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propionamide Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

C[C@H](C(=O)NC1(CCCCC1)C#N)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C21H29N3O3/c1-15(20(25)23-21(14-22)8-5-4-6-9-21)24-10-7-16-11-18(26-2)19(27-3)12-17(16)13-24/h11-12,15H,4-10,13H2,1-3H3,(H,23,25)/t15-/m1/s1