4-[2-oxidanyl-3-(4-phenylpiperidin-1-yl)propoxy]benzoic acid

Systemtic Name: 4-[2-oxidanyl-3-(4-phenylpiperidin-1-yl)propoxy]benzoic acid Openeye Name: 4-[2-hydroxy-3-(4-phenyl-1-piperidyl)propoxy]benzoic acid CAS Name: 4-[2-hydroxy-3-(4-phenyl-1-piperidinyl)propoxy]benzoic acid IUPAC Name: 4-[2-hydroxy-3-(4-phenylpiperidin-1-yl)propoxy]benzoic acid Traditional Name: 4-[2-hydroxy-3-(4-phenylpiperidino)propoxy]benzoic acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC=C2)CC(COC3=CC=C(C=C3)C(=O)O)O

Isomeric SMILES

C1CN(CCC1C2=CC=CC=C2)CC(COC3=CC=C(C=C3)C(=O)O)O

InChI

InChI=1S/C21H25NO4/c23-19(15-26-20-8-6-18(7-9-20)21(24)25)14-22-12-10-17(11-13-22)16-4-2-1-3-5-16/h1-9,17,19,23H,10-15H2,(H,24,25)