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

Systemtic Name: O2-[2-[(2-tert-butylphenyl)amino]-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(2-tert-butylanilino)-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-tert-butylanilino)-2-oxoethyl] ester O4-ethyl ester IUPAC Name: 2-O-[2-(2-tert-butylanilino)-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-tert-butylanilino)-2-keto-ethyl] ester O4-ethyl ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC2=CC=CC=C2C(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC2=CC=CC=C2C(C)(C)C)C

InChI

InChI=1S/C22H28N2O5/c1-7-28-20(26)18-13(2)19(23-14(18)3)21(27)29-12-17(25)24-16-11-9-8-10-15(16)22(4,5)6/h8-11,23H,7,12H2,1-6H3,(H,24,25)