O4-[2-[2-cyanoethyl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-[2-[2-cyanoethyl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-[2-[2-cyanoethyl(2-furylmethyl)amino]-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-[2-[2-cyanoethyl(2-furanylmethyl)amino]-2-oxoethyl] ester O2-ethyl ester IUPAC Name: 4-O-[2-[2-cyanoethyl(furan-2-ylmethyl)amino]-2-oxoethyl] 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[2-[2-cyanoethyl(2-furfuryl)amino]-2-keto-ethyl] ester O2-ethyl ester Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)N(CCC#N)CC2=CC=CO2)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)N(CCC#N)CC2=CC=CO2)C

InChI

InChI=1S/C20H23N3O6/c1-4-27-20(26)18-13(2)17(14(3)22-18)19(25)29-12-16(24)23(9-6-8-21)11-15-7-5-10-28-15/h5,7,10,22H,4,6,9,11-12H2,1-3H3