N-ethyl-5-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]furan-2-carboxamide

Systemtic Name: N-ethyl-5-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]furan-2-carboxamide Openeye Name: N-ethyl-5-[[2-propanoyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]furan-2-carboxamide CAS Name: N-ethyl-5-[[1-(4-methylphenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-2-furancarboxamide IUPAC Name: N-ethyl-5-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]furan-2-carboxamide Traditional Name: N-ethyl-5-[[2-propionyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-2-furamide Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)C)C=C(C=C2)OCC4=CC=C(O4)C(=O)NCC

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)C)C=C(C=C2)OCC4=CC=C(O4)C(=O)NCC

InChI

InChI=1S/C27H30N2O4/c1-4-25(30)29-15-14-19-10-11-21(16-23(19)26(29)20-8-6-18(3)7-9-20)32-17-22-12-13-24(33-22)27(31)28-5-2/h6-13,16,26H,4-5,14-15,17H2,1-3H3,(H,28,31)