ethyl 2,4-dimethyl-1-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-1-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-(1,1-dimethylpropylamino)-2-oxo-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-1-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-1-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[2-(tert-amylamino)-2-keto-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CN1C(=C(C(=C1C2=CC=CC=C2)C)C(=O)OCC)C

Isomeric SMILES

CCC(C)(C)NC(=O)CN1C(=C(C(=C1C2=CC=CC=C2)C)C(=O)OCC)C

InChI

InChI=1S/C22H30N2O3/c1-7-22(5,6)23-18(25)14-24-16(4)19(21(26)27-8-2)15(3)20(24)17-12-10-9-11-13-17/h9-13H,7-8,14H2,1-6H3,(H,23,25)