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

Systemtic Name: O2-[1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-[(1-cyanocyclohexyl)amino]-1-methyl-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-[1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] ester O4-ethyl ester IUPAC Name: 2-O-[1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[(1-cyanocyclohexyl)amino]-2-keto-1-methyl-ethyl] ester O4-ethyl ester Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OC(C)C(=O)NC2(CCCCC2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OC(C)C(=O)NC2(CCCCC2)C#N)C

InChI

InChI=1S/C20H27N3O5/c1-5-27-18(25)15-12(2)16(22-13(15)3)19(26)28-14(4)17(24)23-20(11-21)9-7-6-8-10-20/h14,22H,5-10H2,1-4H3,(H,23,24)