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

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-oxidanylidene-2-(pentylamino)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-oxo-2-(pentylamino)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 5-[1,2-dioxo-2-(pentylamino)ethyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-oxo-2-(pentylamino)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(amylamino)-2-keto-acetyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O5/c1-5-7-8-13-23-21(26)20(25)19-18(15-9-11-16(28-4)12-10-15)17(14(3)24-19)22(27)29-6-2/h9-12,24H,5-8,13H2,1-4H3,(H,23,26)