methyl 5-[[1-methyl-6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinolin-2-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[1-methyl-6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinolin-2-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]furan-2-carboxylate CAS Name: 5-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]furan-2-carboxylate Traditional Name: 5-[(6,7-dihydroxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]furan-2-carboxylic acid methyl ester Formula: C17H19NO5 MolecularWeight: 317.33646

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1CC3=CC=C(O3)C(=O)OC)O)O

Isomeric SMILES

CC1C2=CC(=C(C=C2CCN1CC3=CC=C(O3)C(=O)OC)O)O

InChI

InChI=1S/C17H19NO5/c1-10-13-8-15(20)14(19)7-11(13)5-6-18(10)9-12-3-4-16(23-12)17(21)22-2/h3-4,7-8,10,19-20H,5-6,9H2,1-2H3