(3-methylquinoxalin-2-yl)methyl 2-(methylamino)-5-nitro-benzoate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 2-(methylamino)-5-nitro-benzoate Openeye Name: (3-methylquinoxalin-2-yl)methyl 2-(methylamino)-5-nitro-benzoate CAS Name: 2-(methylamino)-5-nitrobenzoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 2-(methylamino)-5-nitrobenzoate Traditional Name: 2-(methylamino)-5-nitro-benzoic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC

InChI

InChI=1S/C18H16N4O4/c1-11-17(21-16-6-4-3-5-15(16)20-11)10-26-18(23)13-9-12(22(24)25)7-8-14(13)19-2/h3-9,19H,10H2,1-2H3