methyl 5-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonyloxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-oxomethoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]oxymethyl]furan-2-carboxylic acid methyl ester Formula: C23H21NO7S MolecularWeight: 455.48034

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC(=O)C1=CC=C(O1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H21NO7S/c1-29-23(26)21-10-9-19(31-21)15-30-22(25)17-7-4-8-20(13-17)32(27,28)24-12-11-16-5-2-3-6-18(16)14-24/h2-10,13H,11-12,14-15H2,1H3