methyl 5-[[2-[(3-methylphenyl)methyl]-1-oxidanylidene-3,4-dihydroisoquinolin-5-yl]oxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[2-[(3-methylphenyl)methyl]-1-oxidanylidene-3,4-dihydroisoquinolin-5-yl]oxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[[2-(m-tolylmethyl)-1-oxo-3,4-dihydroisoquinolin-5-yl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[2-[(3-methylphenyl)methyl]-1-oxo-3,4-dihydroisoquinolin-5-yl]oxymethyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-[(3-methylphenyl)methyl]-1-oxo-3,4-dihydroisoquinolin-5-yl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[1-keto-2-(3-methylbenzyl)-3,4-dihydroisoquinolin-5-yl]oxymethyl]furan-2-carboxylic acid methyl ester Formula: C24H23NO5 MolecularWeight: 405.44312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC3=C(C2=O)C=CC=C3OCC4=CC=C(O4)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC3=C(C2=O)C=CC=C3OCC4=CC=C(O4)C(=O)OC

InChI

InChI=1S/C24H23NO5/c1-16-5-3-6-17(13-16)14-25-12-11-19-20(23(25)26)7-4-8-21(19)29-15-18-9-10-22(30-18)24(27)28-2/h3-10,13H,11-12,14-15H2,1-2H3