O2-ethyl O4-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxidanylidene-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxidanylidene-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-ethyl O4-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxo-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: 2-O-ethyl 4-O-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxoethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[2-[(4-carbomethoxybenzyl)amino]-2-keto-ethyl] ester O2-ethyl ester Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)NCC2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)NCC2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C21H24N2O7/c1-5-29-21(27)18-12(2)17(13(3)23-18)20(26)30-11-16(24)22-10-14-6-8-15(9-7-14)19(25)28-4/h6-9,23H,5,10-11H2,1-4H3,(H,22,24)