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

Systemtic Name: 2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-N-(pyridin-4-ylmethyl)propanamide Openeye Name: 2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-N-(4-pyridylmethyl)propanamide CAS Name: 2-[[2-(1-oxopropyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: 2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-N-(pyridin-4-ylmethyl)propanamide Traditional Name: 2-[(1-phenyl-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-N-(4-pyridylmethyl)propionamide Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OC(C)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OC(C)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C27H29N3O3/c1-3-25(31)30-16-13-21-9-10-23(17-24(21)26(30)22-7-5-4-6-8-22)33-19(2)27(32)29-18-20-11-14-28-15-12-20/h4-12,14-15,17,19,26H,3,13,16,18H2,1-2H3,(H,29,32)