ethyl 2-methyl-4-(4-methylphenyl)-5-[2-oxidanylidene-2-(pentylamino)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-(4-methylphenyl)-5-[2-oxidanylidene-2-(pentylamino)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-5-[2-oxo-2-(pentylamino)acetyl]-4-(p-tolyl)-1H-pyrrole-3-carboxylate CAS Name: 5-[1,2-dioxo-2-(pentylamino)ethyl]-2-methyl-4-(4-methylphenyl)-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-(4-methylphenyl)-5-[2-oxo-2-(pentylamino)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(amylamino)-2-keto-acetyl]-2-methyl-4-(p-tolyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(=O)C1=C(C(=C(N1)C)C(=O)OCC)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCNC(=O)C(=O)C1=C(C(=C(N1)C)C(=O)OCC)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H28N2O4/c1-5-7-8-13-23-21(26)20(25)19-18(16-11-9-14(3)10-12-16)17(15(4)24-19)22(27)28-6-2/h9-12,24H,5-8,13H2,1-4H3,(H,23,26)