(7-nitroquinolin-8-yl) 2,3,5,6-tetramethylbenzoate

Systemtic Name: (7-nitroquinolin-8-yl) 2,3,5,6-tetramethylbenzoate Openeye Name: (7-nitro-8-quinolyl) 2,3,5,6-tetramethylbenzoate CAS Name: 2,3,5,6-tetramethylbenzoic acid (7-nitro-8-quinolinyl) ester IUPAC Name: (7-nitroquinolin-8-yl) 2,3,5,6-tetramethylbenzoate Traditional Name: 2,3,5,6-tetramethylbenzoic acid (7-nitro-8-quinolyl) ester Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C20H18N2O4/c1-11-10-12(2)14(4)17(13(11)3)20(23)26-19-16(22(24)25)8-7-15-6-5-9-21-18(15)19/h5-10H,1-4H3