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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OC(C)C(=O)NC2(CCCCC2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OC(C)C(=O)NC2(CCCCC2)C#N)C

InChI

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