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

Systemtic Name: O2-[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-isopropyl 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-propan-2-yl ester IUPAC Name: 2-O-[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl] 4-O-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-isopropyl ester O2-[2-keto-2-[[(1S)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C18H27N3O6 MolecularWeight: 381.42348

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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)OC(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O6/c1-7-10(4)19-18(25)21-13(22)8-26-17(24)15-11(5)14(12(6)20-15)16(23)27-9(2)3/h9-10,20H,7-8H2,1-6H3,(H2,19,21,22,25)/t10-/m0/s1