(5-nitroquinolin-8-yl) 3,4,5-trimethoxybenzoate

Systemtic Name: (5-nitroquinolin-8-yl) 3,4,5-trimethoxybenzoate Openeye Name: (5-nitro-8-quinolyl) 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid (5-nitro-8-quinolinyl) ester IUPAC Name: (5-nitroquinolin-8-yl) 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid (5-nitro-8-quinolyl) ester Formula: C19H16N2O7 MolecularWeight: 384.33954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

InChI

InChI=1S/C19H16N2O7/c1-25-15-9-11(10-16(26-2)18(15)27-3)19(22)28-14-7-6-13(21(23)24)12-5-4-8-20-17(12)14/h4-10H,1-3H3