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

Systemtic Name: diethyl 5-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 5-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-[[4-(2,3-dimethylphenyl)-1-piperazinyl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-[[4-(2,3-dimethylphenyl)piperazino]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C24H33N3O4 MolecularWeight: 427.53652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)CN2CCN(CC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)CN2CCN(CC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C24H33N3O4/c1-6-30-23(28)21-18(5)22(24(29)31-7-2)25-19(21)15-26-11-13-27(14-12-26)20-10-8-9-16(3)17(20)4/h8-10,25H,6-7,11-15H2,1-5H3