3,4,5-triethoxy-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide

Systemtic Name: 3,4,5-triethoxy-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Openeye Name: 3,4,5-triethoxy-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide CAS Name: 3,4,5-triethoxy-N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 3,4,5-triethoxy-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Traditional Name: 3,4,5-triethoxy-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC(=C(C(=C3)OCC)OCC)OCC

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC(=C(C(=C3)OCC)OCC)OCC

InChI

InChI=1S/C25H32N2O5/c1-5-23(28)27-12-11-17-9-10-20(13-19(17)16-27)26-25(29)18-14-21(30-6-2)24(32-8-4)22(15-18)31-7-3/h9-10,13-15H,5-8,11-12,16H2,1-4H3,(H,26,29)