(5-nitroquinolin-8-yl) 4-methylbenzoate

Systemtic Name: (5-nitroquinolin-8-yl) 4-methylbenzoate Openeye Name: (5-nitro-8-quinolyl) 4-methylbenzoate CAS Name: 4-methylbenzoic acid (5-nitro-8-quinolinyl) ester IUPAC Name: (5-nitroquinolin-8-yl) 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (5-nitro-8-quinolyl) ester Formula: C17H12N2O4 MolecularWeight: 308.28818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

InChI

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