(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 4,5-dimethoxy-2-nitro-benzoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C20H17ClN2O7 MolecularWeight: 432.81118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)Cl

InChI

InChI=1S/C20H17ClN2O7/c1-27-13-5-4-11-6-12(19(21)22-15(11)7-13)10-30-20(24)14-8-17(28-2)18(29-3)9-16(14)23(25)26/h4-9H,10H2,1-3H3