4-butyl-5-methyl-3-[2-(4-oxidanyl-4-phenyl-piperidin-1-yl)ethoxy]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-butyl-5-methyl-3-[2-(4-oxidanyl-4-phenyl-piperidin-1-yl)ethoxy]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-butyl-3-[2-(4-hydroxy-4-phenyl-1-piperidyl)ethoxy]-5-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-butyl-3-[2-(4-hydroxy-4-phenyl-1-piperidinyl)ethoxy]-5-methyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-butyl-3-[2-(4-hydroxy-4-phenylpiperidin-1-yl)ethoxy]-5-methyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-butyl-3-[2-(4-hydroxy-4-phenyl-piperidino)ethoxy]-5-methyl-1H-pyrrole-2-carboxylic acid Formula: C23H32N2O4 MolecularWeight: 400.51118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=C1OCCN2CCC(CC2)(C3=CC=CC=C3)O)C(=O)O)C

Isomeric SMILES

CCCCC1=C(NC(=C1OCCN2CCC(CC2)(C3=CC=CC=C3)O)C(=O)O)C

InChI

InChI=1S/C23H32N2O4/c1-3-4-10-19-17(2)24-20(22(26)27)21(19)29-16-15-25-13-11-23(28,12-14-25)18-8-6-5-7-9-18/h5-9,24,28H,3-4,10-16H2,1-2H3,(H,26,27)