4,5-dimethyl-3-[5-(4-oxidanyl-4-phenyl-piperidin-1-yl)pentoxy]-1H-pyrrole-2-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1OCCCCCN2CCC(CC2)(C3=CC=CC=C3)O)C(=O)O)C

Isomeric SMILES

CC1=C(NC(=C1OCCCCCN2CCC(CC2)(C3=CC=CC=C3)O)C(=O)O)C

InChI

InChI=1S/C23H32N2O4/c1-17-18(2)24-20(22(26)27)21(17)29-16-8-4-7-13-25-14-11-23(28,12-15-25)19-9-5-3-6-10-19/h3,5-6,9-10,24,28H,4,7-8,11-16H2,1-2H3,(H,26,27)