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

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-(4-methylpiperazin-1-yl)-2-oxo-acetyl]-1H-pyrrole-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-methyl-5-[2-(4-methyl-1-piperazinyl)-1,2-dioxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-(4-methylpiperazin-1-yl)-2-oxoacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-keto-2-(4-methylpiperazino)acetyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)OC)C(=O)C(=O)N3CCN(CC3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)OC)C(=O)C(=O)N3CCN(CC3)C)C

InChI

InChI=1S/C22H27N3O5/c1-5-30-22(28)17-14(2)23-19(18(17)15-6-8-16(29-4)9-7-15)20(26)21(27)25-12-10-24(3)11-13-25/h6-9,23H,5,10-13H2,1-4H3