2-[6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxidanylidene-pyran-3-yl]oxy-N-[(4-methylphenyl)methyl]ethanamide

Systemtic Name: 2-[6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxidanylidene-pyran-3-yl]oxy-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxo-pyran-3-yl]oxy-N-(p-tolylmethyl)acetamide CAS Name: 2-[[6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxo-3-pyranyl]oxy]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-[6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxopyran-3-yl]oxy-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-[6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-keto-pyran-3-yl]oxy-N-(4-methylbenzyl)acetamide Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)COC2=COC(=CC2=O)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)COC2=COC(=CC2=O)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H26N2O4/c1-18-6-8-19(9-7-18)13-26-25(29)17-31-24-16-30-22(12-23(24)28)15-27-11-10-20-4-2-3-5-21(20)14-27/h2-9,12,16H,10-11,13-15,17H2,1H3,(H,26,29)