methyl 2-[2-(4-fluorophenyl)ethanoylamino]-3-oxidanylidene-1,4-dihydroisoquinoline-1-carboxylate

Systemtic Name: methyl 2-[2-(4-fluorophenyl)ethanoylamino]-3-oxidanylidene-1,4-dihydroisoquinoline-1-carboxylate Openeye Name: methyl 2-[[2-(4-fluorophenyl)acetyl]amino]-3-oxo-1,4-dihydroisoquinoline-1-carboxylate CAS Name: 2-[[2-(4-fluorophenyl)-1-oxoethyl]amino]-3-oxo-1,4-dihydroisoquinoline-1-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-fluorophenyl)acetyl]amino]-3-oxo-1,4-dihydroisoquinoline-1-carboxylate Traditional Name: 2-[[2-(4-fluorophenyl)acetyl]amino]-3-keto-1,4-dihydroisoquinoline-1-carboxylic acid methyl ester Formula: C19H17FN2O4 MolecularWeight: 356.347683

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C2=CC=CC=C2CC(=O)N1NC(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1C2=CC=CC=C2CC(=O)N1NC(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C19H17FN2O4/c1-26-19(25)18-15-5-3-2-4-13(15)11-17(24)22(18)21-16(23)10-12-6-8-14(20)9-7-12/h2-9,18H,10-11H2,1H3,(H,21,23)