O2-[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-ethyl O2-[2-[[(1S)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[[[[(2S)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester O4-ethyl ester IUPAC Name: 2-O-[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[2-keto-2-[[(1S)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C17H25N3O6 MolecularWeight: 367.3969

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC(=O)C1=C(C(=C(N1)C)C(=O)OCC)C

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)COC(=O)C1=C(C(=C(N1)C)C(=O)OCC)C

InChI

InChI=1S/C17H25N3O6/c1-6-9(3)18-17(24)20-12(21)8-26-16(23)14-10(4)13(11(5)19-14)15(22)25-7-2/h9,19H,6-8H2,1-5H3,(H2,18,20,21,24)/t9-/m0/s1