4-[2-(4-oxidanyl-1-phenethyl-piperidin-4-yl)ethylamino]benzoic acid

Systemtic Name: 4-[2-(4-oxidanyl-1-phenethyl-piperidin-4-yl)ethylamino]benzoic acid Openeye Name: 4-[2-(4-hydroxy-1-phenethyl-4-piperidyl)ethylamino]benzoic acid CAS Name: 4-[2-(4-hydroxy-1-phenethyl-4-piperidinyl)ethylamino]benzoic acid IUPAC Name: 4-[2-(4-hydroxy-1-phenethylpiperidin-4-yl)ethylamino]benzoic acid Traditional Name: 4-[2-(4-hydroxy-1-phenethyl-4-piperidyl)ethylamino]benzoic acid Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CCNC2=CC=C(C=C2)C(=O)O)O)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1(CCNC2=CC=C(C=C2)C(=O)O)O)CCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3/c25-21(26)19-6-8-20(9-7-19)23-14-11-22(27)12-16-24(17-13-22)15-10-18-4-2-1-3-5-18/h1-9,23,27H,10-17H2,(H,25,26)