4-[4-(3-phenylmethoxypropoxy)phenyl]-3,5-bis(quinolin-7-ylmethoxy)piperidine-1-carboxylic acid

Systemtic Name: 4-[4-(3-phenylmethoxypropoxy)phenyl]-3,5-bis(quinolin-7-ylmethoxy)piperidine-1-carboxylic acid Openeye Name: 4-[4-(3-benzyloxypropoxy)phenyl]-3,5-bis(7-quinolylmethoxy)piperidine-1-carboxylic acid CAS Name: 4-[4-(3-phenylmethoxypropoxy)phenyl]-3,5-bis(7-quinolinylmethoxy)-1-piperidinecarboxylic acid IUPAC Name: 4-[4-(3-phenylmethoxypropoxy)phenyl]-3,5-bis(quinolin-7-ylmethoxy)piperidine-1-carboxylic acid Traditional Name: 4-[4-(3-benzoxypropoxy)phenyl]-3,5-bis(7-quinolylmethoxy)piperidine-1-carboxylic acid Formula: C42H41N3O6 MolecularWeight: 683.79144

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(CN1C(=O)O)OCC2=CC3=C(C=CC=N3)C=C2)C4=CC=C(C=C4)OCCCOCC5=CC=CC=C5)OCC6=CC7=C(C=CC=N7)C=C6

Isomeric SMILES

C1C(C(C(CN1C(=O)O)OCC2=CC3=C(C=CC=N3)C=C2)C4=CC=C(C=C4)OCCCOCC5=CC=CC=C5)OCC6=CC7=C(C=CC=N7)C=C6

InChI

InChI=1S/C42H41N3O6/c46-42(47)45-25-39(50-28-31-11-13-33-9-4-19-43-37(33)23-31)41(40(26-45)51-29-32-12-14-34-10-5-20-44-38(34)24-32)35-15-17-36(18-16-35)49-22-6-21-48-27-30-7-2-1-3-8-30/h1-5,7-20,23-24,39-41H,6,21-22,25-29H2,(H,46,47)