[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-methyl-benzo[g][1]benzofuran-5-yl] ethanoate

Systemtic Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-methyl-benzo[g][1]benzofuran-5-yl] ethanoate Openeye Name: [3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-benzo[g]benzofuran-5-yl] acetate CAS Name: acetic acid [3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-methyl-5-benzo[g]benzofuranyl] ester IUPAC Name: [3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methylbenzo[g][1]benzofuran-5-yl] acetate Traditional Name: acetic acid [3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-benzo[g]benzofuran-5-yl] ester Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)OC(=O)C)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)OC(=O)C)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C25H21NO4/c1-15-23(25(28)26-12-11-17-7-3-4-8-18(17)14-26)21-13-22(30-16(2)27)19-9-5-6-10-20(19)24(21)29-15/h3-10,13H,11-12,14H2,1-2H3