(2-methylquinolin-8-yl) 3-nitrobenzoate

Systemtic Name: (2-methylquinolin-8-yl) 3-nitrobenzoate Openeye Name: (2-methyl-8-quinolyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-methyl-8-quinolyl) ester Formula: C17H12N2O4 MolecularWeight: 308.28818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12N2O4/c1-11-8-9-12-4-3-7-15(16(12)18-11)23-17(20)13-5-2-6-14(10-13)19(21)22/h2-10H,1H3