methyl 2,4-dimethyl-5-(4-phenylpiperazin-1-yl)carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-(4-phenylpiperazin-1-yl)carbonyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-(4-phenylpiperazine-1-carbonyl)-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-(4-phenyl-1-piperazinyl)methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-(4-phenylpiperazine-1-carbonyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-(4-phenylpiperazine-1-carbonyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H23N3O3/c1-13-16(19(24)25-3)14(2)20-17(13)18(23)22-11-9-21(10-12-22)15-7-5-4-6-8-15/h4-8,20H,9-12H2,1-3H3