5-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethoxy]-2-[(3-methylphenyl)methyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 5-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethoxy]-2-[(3-methylphenyl)methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 5-(2-indolin-1-yl-2-oxo-ethoxy)-2-(m-tolylmethyl)-3,4-dihydroisoquinolin-1-one CAS Name: 5-[2-(2,3-dihydroindol-1-yl)-2-oxoethoxy]-2-[(3-methylphenyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 5-[2-(2,3-dihydroindol-1-yl)-2-oxoethoxy]-2-[(3-methylphenyl)methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 5-(2-indolin-1-yl-2-keto-ethoxy)-2-(3-methylbenzyl)-3,4-dihydroisocarbostyril Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC3=C(C2=O)C=CC=C3OCC(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC3=C(C2=O)C=CC=C3OCC(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C27H26N2O3/c1-19-6-4-7-20(16-19)17-28-14-13-22-23(27(28)31)9-5-11-25(22)32-18-26(30)29-15-12-21-8-2-3-10-24(21)29/h2-11,16H,12-15,17-18H2,1H3