ethyl 1-[3-[1,4-dimethyl-2,3-bis(oxidanylidene)quinoxalin-6-yl]sulfonylpropanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[1,4-dimethyl-2,3-bis(oxidanylidene)quinoxalin-6-yl]sulfonylpropanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-(1,4-dimethyl-2,3-dioxo-quinoxalin-6-yl)sulfonylpropanoyl]piperidine-3-carboxylate CAS Name: 1-[3-[(1,4-dimethyl-2,3-dioxo-6-quinoxalinyl)sulfonyl]-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(1,4-dimethyl-2,3-dioxoquinoxalin-6-yl)sulfonylpropanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-(2,3-diketo-1,4-dimethyl-quinoxalin-6-yl)sulfonylpropanoyl]nipecotic acid ethyl ester Formula: C21H27N3O7S MolecularWeight: 465.51998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CCS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C(=O)N3C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CCS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C(=O)N3C)C

InChI

InChI=1S/C21H27N3O7S/c1-4-31-21(28)14-6-5-10-24(13-14)18(25)9-11-32(29,30)15-7-8-16-17(12-15)23(3)20(27)19(26)22(16)2/h7-8,12,14H,4-6,9-11,13H2,1-3H3