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

Systemtic Name: N-(3-chlorophenyl)-5-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]furan-2-carboxamide Openeye Name: N-(3-chlorophenyl)-5-[[2-propanoyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]furan-2-carboxamide CAS Name: N-(3-chlorophenyl)-5-[[1-(4-methylphenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-2-furancarboxamide IUPAC Name: N-(3-chlorophenyl)-5-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]furan-2-carboxamide Traditional Name: N-(3-chlorophenyl)-5-[[2-propionyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-2-furamide Formula: C31H29ClN2O4 MolecularWeight: 529.02596

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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)NC5=CC(=CC=C5)Cl

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)C)C=C(C=C2)OCC4=CC=C(O4)C(=O)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C31H29ClN2O4/c1-3-29(35)34-16-15-21-11-12-25(18-27(21)30(34)22-9-7-20(2)8-10-22)37-19-26-13-14-28(38-26)31(36)33-24-6-4-5-23(32)17-24/h4-14,17-18,30H,3,15-16,19H2,1-2H3,(H,33,36)