4,5-dimethyl-3-[2-(4-phenylpiperidin-1-yl)ethoxy]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4,5-dimethyl-3-[2-(4-phenylpiperidin-1-yl)ethoxy]-1H-pyrrole-2-carboxylic acid Openeye Name: 4,5-dimethyl-3-[2-(4-phenyl-1-piperidyl)ethoxy]-1H-pyrrole-2-carboxylic acid CAS Name: 4,5-dimethyl-3-[2-(4-phenyl-1-piperidinyl)ethoxy]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4,5-dimethyl-3-[2-(4-phenylpiperidin-1-yl)ethoxy]-1H-pyrrole-2-carboxylic acid Traditional Name: 4,5-dimethyl-3-[2-(4-phenylpiperidino)ethoxy]-1H-pyrrole-2-carboxylic acid Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1OCCN2CCC(CC2)C3=CC=CC=C3)C(=O)O)C

Isomeric SMILES

CC1=C(NC(=C1OCCN2CCC(CC2)C3=CC=CC=C3)C(=O)O)C

InChI

InChI=1S/C20H26N2O3/c1-14-15(2)21-18(20(23)24)19(14)25-13-12-22-10-8-17(9-11-22)16-6-4-3-5-7-16/h3-7,17,21H,8-13H2,1-2H3,(H,23,24)