2-[[2-(2-methylpropanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[[2-(2-methylpropanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[[2-(2-methylpropanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[[2-(2-methyl-1-oxopropyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[[2-(2-methylpropanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[(2-isobutyryl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-N-(3-pyridylmethyl)acetamide Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC(C)C(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C27H29N3O3/c1-19(2)27(32)30-14-12-21-10-11-23(15-24(21)26(30)22-8-4-3-5-9-22)33-18-25(31)29-17-20-7-6-13-28-16-20/h3-11,13,15-16,19,26H,12,14,17-18H2,1-2H3,(H,29,31)