4-[4-[4-[4-(4-methoxybutoxy)phenyl]-4-oxidanyl-piperidin-1-yl]phenyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[4-[4-[4-(4-methoxybutoxy)phenyl]-4-oxidanyl-piperidin-1-yl]phenyl]piperazine-1-carboxylic acid Openeye Name: 4-[4-[4-hydroxy-4-[4-(4-methoxybutoxy)phenyl]-1-piperidyl]phenyl]piperazine-1-carboxylic acid CAS Name: 4-[4-[4-hydroxy-4-[4-(4-methoxybutoxy)phenyl]-1-piperidinyl]phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[4-[4-hydroxy-4-[4-(4-methoxybutoxy)phenyl]piperidin-1-yl]phenyl]piperazine-1-carboxylic acid Traditional Name: 4-[4-[4-hydroxy-4-[4-(4-methoxybutoxy)phenyl]piperidino]phenyl]piperazine-1-carboxylic acid Formula: C27H37N3O5 MolecularWeight: 483.59978

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCOC1=CC=C(C=C1)C2(CCN(CC2)C3=CC=C(C=C3)N4CCN(CC4)C(=O)O)O

Isomeric SMILES

COCCCCOC1=CC=C(C=C1)C2(CCN(CC2)C3=CC=C(C=C3)N4CCN(CC4)C(=O)O)O

InChI

InChI=1S/C27H37N3O5/c1-34-20-2-3-21-35-25-10-4-22(5-11-25)27(33)12-14-28(15-13-27)23-6-8-24(9-7-23)29-16-18-30(19-17-29)26(31)32/h4-11,33H,2-3,12-21H2,1H3,(H,31,32)