ethyl 2,4-dimethyl-1-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-1-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-1-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-1-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-(4-methylpiperazino)ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C)C2=CC=CC=C2)CC(=O)N3CCN(CC3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C)C2=CC=CC=C2)CC(=O)N3CCN(CC3)C)C

InChI

InChI=1S/C22H29N3O3/c1-5-28-22(27)20-16(2)21(18-9-7-6-8-10-18)25(17(20)3)15-19(26)24-13-11-23(4)12-14-24/h6-10H,5,11-15H2,1-4H3