3-cyano-N-[2-(2-methoxyethyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]-4-propan-2-yloxy-benzamide

Systemtic Name: 3-cyano-N-[2-(2-methoxyethyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]-4-propan-2-yloxy-benzamide Openeye Name: 3-cyano-4-isopropoxy-N-[2-(2-methoxyethyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]benzamide CAS Name: 3-cyano-N-[2-(2-methoxyethyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]-4-propan-2-yloxybenzamide IUPAC Name: 3-cyano-N-[2-(2-methoxyethyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]-4-propan-2-yloxybenzamide Traditional Name: 3-cyano-4-isopropoxy-N-[2-(2-methoxyethyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]benzamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(CN(C3)CCOC)(C)C)C#N

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(CN(C3)CCOC)(C)C)C#N

InChI

InChI=1S/C25H31N3O3/c1-17(2)31-23-9-6-18(12-19(23)14-26)24(29)27-21-7-8-22-20(13-21)15-28(10-11-30-5)16-25(22,3)4/h6-9,12-13,17H,10-11,15-16H2,1-5H3,(H,27,29)