ethyl 1-[3-[(4-bromophenyl)sulfonylamino]quinoxalin-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[(4-bromophenyl)sulfonylamino]quinoxalin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[(4-bromophenyl)sulfonylamino]quinoxalin-2-yl]piperidine-4-carboxylate CAS Name: 1-[3-[(4-bromophenyl)sulfonylamino]-2-quinoxalinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(4-bromophenyl)sulfonylamino]quinoxalin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-(brosylamino)quinoxalin-2-yl]isonipecotic acid ethyl ester Formula: C22H23BrN4O4S MolecularWeight: 519.41142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H23BrN4O4S/c1-2-31-22(28)15-11-13-27(14-12-15)21-20(24-18-5-3-4-6-19(18)25-21)26-32(29,30)17-9-7-16(23)8-10-17/h3-10,15H,2,11-14H2,1H3,(H,24,26)