ethyl 1-[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-(2,6-diethylanilino)-2-oxo-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[2-(2,6-diethylanilino)-2-oxoethyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2,6-diethylanilino)-2-oxoethyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[2-(2,6-diethylanilino)-2-keto-ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CN2C(=CC(=C2C)C(=O)OCC)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CN2C(=CC(=C2C)C(=O)OCC)C

InChI

InChI=1S/C21H28N2O3/c1-6-16-10-9-11-17(7-2)20(16)22-19(24)13-23-14(4)12-18(15(23)5)21(25)26-8-3/h9-12H,6-8,13H2,1-5H3,(H,22,24)