3-[4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]-1-(3-oxidanylpropyl)-6-(quinolin-7-ylmethoxy)cyclohex-2-en-1-yl]piperidine-1-carboxylic acid

Systemtic Name: 3-[4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]-1-(3-oxidanylpropyl)-6-(quinolin-7-ylmethoxy)cyclohex-2-en-1-yl]piperidine-1-carboxylic acid Openeye Name: 3-[1-(3-hydroxypropyl)-4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]-6-(7-quinolylmethoxy)cyclohex-2-en-1-yl]piperidine-1-carboxylic acid CAS Name: 3-[1-(3-hydroxypropyl)-4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]-6-(7-quinolinylmethoxy)-1-cyclohex-2-enyl]-1-piperidinecarboxylic acid IUPAC Name: 3-[1-(3-hydroxypropyl)-4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]-6-(quinolin-7-ylmethoxy)cyclohex-2-en-1-yl]piperidine-1-carboxylic acid Traditional Name: 3-[1-(3-hydroxypropyl)-4-[4-(3-o-anisyloxypropoxy)phenyl]-6-(7-quinolylmethoxy)cyclohex-2-en-1-yl]piperidine-1-carboxylic acid Formula: C42H50N2O7 MolecularWeight: 694.8556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1COCCCOC2=CC=C(C=C2)C3CC(C(C=C3)(CCCO)C4CCCN(C4)C(=O)O)OCC5=CC6=C(C=CC=N6)C=C5

Isomeric SMILES

COC1=CC=CC=C1COCCCOC2=CC=C(C=C2)C3CC(C(C=C3)(CCCO)C4CCCN(C4)C(=O)O)OCC5=CC6=C(C=CC=N6)C=C5

InChI

InChI=1S/C42H50N2O7/c1-48-39-11-3-2-8-35(39)30-49-24-7-25-50-37-16-14-32(15-17-37)34-18-20-42(19-6-23-45,36-10-5-22-44(28-36)41(46)47)40(27-34)51-29-31-12-13-33-9-4-21-43-38(33)26-31/h2-4,8-9,11-18,20-21,26,34,36,40,45H,5-7,10,19,22-25,27-30H2,1H3,(H,46,47)