O2-ethyl O4-[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-ethyl O4-[2-(isopentylcarbamoylamino)-2-oxo-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-[2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: 2-O-ethyl 4-O-[2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-[2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H27N3O6 MolecularWeight: 381.42348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)NC(=O)NCCC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)NC(=O)NCCC(C)C)C

InChI

InChI=1S/C18H27N3O6/c1-6-26-17(24)15-11(4)14(12(5)20-15)16(23)27-9-13(22)21-18(25)19-8-7-10(2)3/h10,20H,6-9H2,1-5H3,(H2,19,21,22,25)