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

Systemtic Name: O2-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxo-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]amino]-2-oxoethyl] ester O4-ethyl ester IUPAC Name: 2-O-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-keto-ethyl] ester O4-ethyl ester Formula: C21H29N3O6 MolecularWeight: 419.47146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC(=O)NCCC2=CCCCC2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC(=O)NCCC2=CCCCC2)C

InChI

InChI=1S/C21H29N3O6/c1-4-29-19(26)17-13(2)18(23-14(17)3)20(27)30-12-16(25)24-21(28)22-11-10-15-8-6-5-7-9-15/h8,23H,4-7,9-12H2,1-3H3,(H2,22,24,25,28)