1-(3-nitrophenyl)ethyl quinoline-2-carboxylate

Systemtic Name: 1-(3-nitrophenyl)ethyl quinoline-2-carboxylate Openeye Name: 1-(3-nitrophenyl)ethyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid 1-(3-nitrophenyl)ethyl ester IUPAC Name: 1-(3-nitrophenyl)ethyl quinoline-2-carboxylate Traditional Name: quinaldic acid 1-(3-nitrophenyl)ethyl ester Formula: C18H14N2O4 MolecularWeight: 322.31476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H14N2O4/c1-12(14-6-4-7-15(11-14)20(22)23)24-18(21)17-10-9-13-5-2-3-8-16(13)19-17/h2-12H,1H3