methyl 4-methyl-2-[2-(2-nitrophenyl)ethanoyloxymethyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[2-(2-nitrophenyl)ethanoyloxymethyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[[2-(2-nitrophenyl)acetyl]oxymethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[2-(2-nitrophenyl)-1-oxoethoxy]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-(2-nitrophenyl)acetyl]oxymethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[2-(2-nitrophenyl)acetyl]oxymethyl]quinoline-3-carboxylic acid methyl ester Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CC3=CC=CC=C3[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CC3=CC=CC=C3[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C21H18N2O6/c1-13-15-8-4-5-9-16(15)22-17(20(13)21(25)28-2)12-29-19(24)11-14-7-3-6-10-18(14)23(26)27/h3-10H,11-12H2,1-2H3