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

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: (3-methylquinoxalin-2-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C20H20N4O5 MolecularWeight: 396.3966

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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-])NCCOC

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O5/c1-13-19(23-18-6-4-3-5-17(18)22-13)12-29-20(25)15-11-14(24(26)27)7-8-16(15)21-9-10-28-2/h3-8,11,21H,9-10,12H2,1-2H3