(2-methylquinolin-8-yl) 2-methyl-3-nitro-benzoate

Systemtic Name: (2-methylquinolin-8-yl) 2-methyl-3-nitro-benzoate Openeye Name: (2-methyl-8-quinolyl) 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid (2-methyl-8-quinolyl) ester Formula: C18H14N2O4 MolecularWeight: 322.31476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C)C=C1

InChI

InChI=1S/C18H14N2O4/c1-11-9-10-13-5-3-8-16(17(13)19-11)24-18(21)14-6-4-7-15(12(14)2)20(22)23/h3-10H,1-2H3