ethyl 3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate

Systemtic Name: ethyl 3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate Openeye Name: ethyl 3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate CAS Name: 3-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate Traditional Name: 3-[4-(3-nitrophenyl)sulfonylpiperazino]quinoxaline-2-carboxylic acid ethyl ester Formula: C21H21N5O6S MolecularWeight: 471.48634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O6S/c1-2-32-21(27)19-20(23-18-9-4-3-8-17(18)22-19)24-10-12-25(13-11-24)33(30,31)16-7-5-6-15(14-16)26(28)29/h3-9,14H,2,10-13H2,1H3