(2-nitrophenyl)methyl quinoline-2-carboxylate

Systemtic Name: (2-nitrophenyl)methyl quinoline-2-carboxylate Openeye Name: (2-nitrophenyl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (2-nitrobenzyl) ester Formula: C17H12N2O4 MolecularWeight: 308.28818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O4/c20-17(15-10-9-12-5-1-3-7-14(12)18-15)23-11-13-6-2-4-8-16(13)19(21)22/h1-10H,11H2