(3-methylquinoxalin-2-yl)methyl 4-ethoxy-3-nitro-benzoate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 4-ethoxy-3-nitro-benzoate Openeye Name: (3-methylquinoxalin-2-yl)methyl 4-ethoxy-3-nitro-benzoate CAS Name: 4-ethoxy-3-nitrobenzoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 4-ethoxy-3-nitrobenzoate Traditional Name: 4-ethoxy-3-nitro-benzoic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3N=C2C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3N=C2C)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O5/c1-3-26-18-9-8-13(10-17(18)22(24)25)19(23)27-11-16-12(2)20-14-6-4-5-7-15(14)21-16/h4-10H,3,11H2,1-2H3