2-(2-methyl-6-nitro-4-phenyl-quinolin-3-yl)ethanoate

Systemtic Name: 2-(2-methyl-6-nitro-4-phenyl-quinolin-3-yl)ethanoate Openeye Name: 2-(2-methyl-6-nitro-4-phenyl-3-quinolyl)acetate CAS Name: 2-(2-methyl-6-nitro-4-phenyl-3-quinolinyl)acetate IUPAC Name: 2-(2-methyl-6-nitro-4-phenylquinolin-3-yl)acetate Traditional Name: 2-(2-methyl-6-nitro-4-phenyl-3-quinolyl)acetate Formula: C18H13N2O4- MolecularWeight: 321.30682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=C(C=CC2=N1)[N+](=O)[O-])C3=CC=CC=C3)CC(=O)[O-]

Isomeric SMILES

CC1=C(C(=C2C=C(C=CC2=N1)[N+](=O)[O-])C3=CC=CC=C3)CC(=O)[O-]

InChI

InChI=1S/C18H14N2O4/c1-11-14(10-17(21)22)18(12-5-3-2-4-6-12)15-9-13(20(23)24)7-8-16(15)19-11/h2-9H,10H2,1H3,(H,21,22)/p-1