ethyl 3-ethoxy-7-[(4-methoxyphenyl)methylamino]-6-nitro-quinoxaline-2-carboxylate

Systemtic Name: ethyl 3-ethoxy-7-[(4-methoxyphenyl)methylamino]-6-nitro-quinoxaline-2-carboxylate Openeye Name: ethyl 3-ethoxy-7-[(4-methoxyphenyl)methylamino]-6-nitro-quinoxaline-2-carboxylate CAS Name: 3-ethoxy-7-[(4-methoxyphenyl)methylamino]-6-nitro-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-ethoxy-7-[(4-methoxyphenyl)methylamino]-6-nitroquinoxaline-2-carboxylate Traditional Name: 3-ethoxy-6-nitro-7-(p-anisylamino)quinoxaline-2-carboxylic acid ethyl ester Formula: C21H22N4O6 MolecularWeight: 426.42258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=CC(=C(C=C2N=C1C(=O)OCC)NCC3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=NC2=CC(=C(C=C2N=C1C(=O)OCC)NCC3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O6/c1-4-30-20-19(21(26)31-5-2)23-15-10-17(18(25(27)28)11-16(15)24-20)22-12-13-6-8-14(29-3)9-7-13/h6-11,22H,4-5,12H2,1-3H3