4-[4-(4-hexoxyphenyl)-4-oxidanyl-piperidin-1-yl]benzoic acid

Systemtic Name: 4-[4-(4-hexoxyphenyl)-4-oxidanyl-piperidin-1-yl]benzoic acid Openeye Name: 4-[4-(4-hexoxyphenyl)-4-hydroxy-1-piperidyl]benzoic acid CAS Name: 4-[4-(4-hexoxyphenyl)-4-hydroxy-1-piperidinyl]benzoic acid IUPAC Name: 4-[4-(4-hexoxyphenyl)-4-hydroxypiperidin-1-yl]benzoic acid Traditional Name: 4-[4-(4-hexoxyphenyl)-4-hydroxy-piperidino]benzoic acid Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2(CCN(CC2)C3=CC=C(C=C3)C(=O)O)O

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2(CCN(CC2)C3=CC=C(C=C3)C(=O)O)O

InChI

InChI=1S/C24H31NO4/c1-2-3-4-5-18-29-22-12-8-20(9-13-22)24(28)14-16-25(17-15-24)21-10-6-19(7-11-21)23(26)27/h6-13,28H,2-5,14-18H2,1H3,(H,26,27)