tert-butyl 4-(1-ethyl-3-methyl-2-oxidanylidene-quinoxalin-6-yl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(1-ethyl-3-methyl-2-oxidanylidene-quinoxalin-6-yl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(1-ethyl-3-methyl-2-oxo-quinoxaline-6-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(1-ethyl-3-methyl-2-oxo-6-quinoxalinyl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-ethyl-3-methyl-2-oxoquinoxaline-6-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(1-ethyl-2-keto-3-methyl-quinoxaline-6-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C)N=C(C1=O)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C)N=C(C1=O)C

InChI

InChI=1S/C21H28N4O4/c1-6-25-17-8-7-15(13-16(17)22-14(2)18(25)26)19(27)23-9-11-24(12-10-23)20(28)29-21(3,4)5/h7-8,13H,6,9-12H2,1-5H3