3-methoxy-7-[4-(4-methoxyphenyl)piperazin-1-yl]-6-nitro-quinoxaline-2-carboxylate

Systemtic Name: 3-methoxy-7-[4-(4-methoxyphenyl)piperazin-1-yl]-6-nitro-quinoxaline-2-carboxylate Openeye Name: 3-methoxy-7-[4-(4-methoxyphenyl)piperazin-1-yl]-6-nitro-quinoxaline-2-carboxylate CAS Name: 3-methoxy-7-[4-(4-methoxyphenyl)-1-piperazinyl]-6-nitro-2-quinoxalinecarboxylate IUPAC Name: 3-methoxy-7-[4-(4-methoxyphenyl)piperazin-1-yl]-6-nitroquinoxaline-2-carboxylate Traditional Name: 3-methoxy-7-[4-(4-methoxyphenyl)piperazino]-6-nitro-quinoxaline-2-carboxylate Formula: C21H20N5O6- MolecularWeight: 438.4134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C4C(=C3)N=C(C(=N4)OC)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C4C(=C3)N=C(C(=N4)OC)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O6/c1-31-14-5-3-13(4-6-14)24-7-9-25(10-8-24)17-11-15-16(12-18(17)26(29)30)23-20(32-2)19(22-15)21(27)28/h3-6,11-12H,7-10H2,1-2H3,(H,27,28)/p-1