(2-methylquinolin-8-yl) 4-chloranyl-3-nitro-benzoate

Systemtic Name: (2-methylquinolin-8-yl) 4-chloranyl-3-nitro-benzoate Openeye Name: (2-methyl-8-quinolyl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid (2-methyl-8-quinolyl) ester Formula: C17H11ClN2O4 MolecularWeight: 342.73324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11ClN2O4/c1-10-5-6-11-3-2-4-15(16(11)19-10)24-17(21)12-7-8-13(18)14(9-12)20(22)23/h2-9H,1H3