ethyl 2,5-dimethyl-1-[2-[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-1-[2-[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-[2-(isopentylcarbamoylamino)-2-oxo-ethoxy]-2-oxo-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-[2-[2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethoxy]-2-oxoethyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-1-[2-[2-(3-methylbutylcarbamoylamino)-2-oxoethoxy]-2-oxoethyl]pyrrole-3-carboxylate Traditional Name: 1-[2-[2-(isoamylcarbamoylamino)-2-keto-ethoxy]-2-keto-ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C19H29N3O6 MolecularWeight: 395.45006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)OCC(=O)NC(=O)NCCC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)OCC(=O)NC(=O)NCCC(C)C)C

InChI

InChI=1S/C19H29N3O6/c1-6-27-18(25)15-9-13(4)22(14(15)5)10-17(24)28-11-16(23)21-19(26)20-8-7-12(2)3/h9,12H,6-8,10-11H2,1-5H3,(H2,20,21,23,26)