methyl 2,4-dimethyl-5-[2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-[4-(m-tolylmethyl)piperazin-1-yl]acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-1-oxoethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[4-(3-methylbenzyl)piperazino]acetyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)CC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)CC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

InChI

InChI=1S/C22H29N3O3/c1-15-6-5-7-18(12-15)13-24-8-10-25(11-9-24)14-19(26)21-16(2)20(17(3)23-21)22(27)28-4/h5-7,12,23H,8-11,13-14H2,1-4H3