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

Systemtic Name: ethyl 4-[2-[4-(2-hydroxyphenyl)piperazin-1-yl]ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-[4-(2-hydroxyphenyl)-1-piperazinyl]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-[4-(2-hydroxyphenyl)piperazino]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)CN2CCN(CC2)C3=CC=CC=C3O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)CN2CCN(CC2)C3=CC=CC=C3O)C)C

InChI

InChI=1S/C21H27N3O4/c1-4-28-21(27)20-15(3)22-14(2)19(20)18(26)13-23-9-11-24(12-10-23)16-7-5-6-8-17(16)25/h5-8,22,25H,4,9-13H2,1-3H3