ethyl 1-[(5-ethoxycarbonyl-2-methyl-furan-3-yl)methyl]-2-oxidanylidene-quinoline-4-carboxylate

Systemtic Name: ethyl 1-[(5-ethoxycarbonyl-2-methyl-furan-3-yl)methyl]-2-oxidanylidene-quinoline-4-carboxylate Openeye Name: ethyl 1-[(5-ethoxycarbonyl-2-methyl-3-furyl)methyl]-2-oxo-quinoline-4-carboxylate CAS Name: 1-[(5-ethoxycarbonyl-2-methyl-3-furanyl)methyl]-2-oxo-4-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(5-ethoxycarbonyl-2-methylfuran-3-yl)methyl]-2-oxoquinoline-4-carboxylate Traditional Name: 1-[(5-carbethoxy-2-methyl-3-furyl)methyl]-2-keto-cinchoninic acid ethyl ester Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=O)N(C2=CC=CC=C21)CC3=C(OC(=C3)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=CC(=O)N(C2=CC=CC=C21)CC3=C(OC(=C3)C(=O)OCC)C

InChI

InChI=1S/C21H21NO6/c1-4-26-20(24)16-11-19(23)22(17-9-7-6-8-15(16)17)12-14-10-18(28-13(14)3)21(25)27-5-2/h6-11H,4-5,12H2,1-3H3