(2-nitrophenyl)methyl 2,6-dimethylquinoline-4-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 2,6-dimethylquinoline-4-carboxylate Openeye Name: (2-nitrophenyl)methyl 2,6-dimethylquinoline-4-carboxylate CAS Name: 2,6-dimethyl-4-quinolinecarboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 2,6-dimethylquinoline-4-carboxylate Traditional Name: 2,6-dimethylcinchoninic acid (2-nitrobenzyl) ester Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C19H16N2O4/c1-12-7-8-17-15(9-12)16(10-13(2)20-17)19(22)25-11-14-5-3-4-6-18(14)21(23)24/h3-10H,11H2,1-2H3