2-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(2-pyrrolidin-1-ylethyl)ethanamide

Systemtic Name: 2-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(2-pyrrolidin-1-ylethyl)ethanamide Openeye Name: 2-[[2-propanoyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(2-pyrrolidin-1-ylethyl)acetamide CAS Name: 2-[[1-(4-methylphenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-[2-(1-pyrrolidinyl)ethyl]acetamide IUPAC Name: 2-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(2-pyrrolidin-1-ylethyl)acetamide Traditional Name: 2-[[2-propionyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(2-pyrrolidinoethyl)acetamide Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)C)C=C(C=C2)OCC(=O)NCCN4CCCC4

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)C)C=C(C=C2)OCC(=O)NCCN4CCCC4

InChI

InChI=1S/C27H35N3O3/c1-3-26(32)30-16-12-21-10-11-23(18-24(21)27(30)22-8-6-20(2)7-9-22)33-19-25(31)28-13-17-29-14-4-5-15-29/h6-11,18,27H,3-5,12-17,19H2,1-2H3,(H,28,31)