diethyl 5-[[4-(4-hydroxyphenyl)piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 5-[[4-(4-hydroxyphenyl)piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 5-[[4-(4-hydroxyphenyl)piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-[[4-(4-hydroxyphenyl)-1-piperazinyl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[4-(4-hydroxyphenyl)piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-[[4-(4-hydroxyphenyl)piperazino]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C22H29N3O5 MolecularWeight: 415.48276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)CN2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)CN2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C22H29N3O5/c1-4-29-21(27)19-15(3)20(22(28)30-5-2)23-18(19)14-24-10-12-25(13-11-24)16-6-8-17(26)9-7-16/h6-9,23,26H,4-5,10-14H2,1-3H3