tert-butyl 3-[(2,3-dimethoxy-6-methyl-7-nitro-quinoxalin-5-yl)carbonylamino]propanoate

Systemtic Name: tert-butyl 3-[(2,3-dimethoxy-6-methyl-7-nitro-quinoxalin-5-yl)carbonylamino]propanoate Openeye Name: tert-butyl 3-[(2,3-dimethoxy-6-methyl-7-nitro-quinoxaline-5-carbonyl)amino]propanoate CAS Name: 3-[[(2,3-dimethoxy-6-methyl-7-nitro-5-quinoxalinyl)-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(2,3-dimethoxy-6-methyl-7-nitroquinoxaline-5-carbonyl)amino]propanoate Traditional Name: 3-[(2,3-dimethoxy-6-methyl-7-nitro-quinoxaline-5-carbonyl)amino]propionic acid tert-butyl ester Formula: C19H24N4O7 MolecularWeight: 420.41646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1C(=O)NCCC(=O)OC(C)(C)C)N=C(C(=N2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=C1C(=O)NCCC(=O)OC(C)(C)C)N=C(C(=N2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O7/c1-10-12(23(26)27)9-11-15(22-18(29-6)17(21-11)28-5)14(10)16(25)20-8-7-13(24)30-19(2,3)4/h9H,7-8H2,1-6H3,(H,20,25)