2-cycloheptyl-2-[2-(2-methylpropyl)-4-(quinolin-2-ylmethoxy)phenyl]ethanoic acid

Systemtic Name: 2-cycloheptyl-2-[2-(2-methylpropyl)-4-(quinolin-2-ylmethoxy)phenyl]ethanoic acid Openeye Name: 2-cycloheptyl-2-[2-isobutyl-4-(2-quinolylmethoxy)phenyl]acetic acid CAS Name: 2-cycloheptyl-2-[2-(2-methylpropyl)-4-(2-quinolinylmethoxy)phenyl]acetic acid IUPAC Name: 2-cycloheptyl-2-[2-(2-methylpropyl)-4-(quinolin-2-ylmethoxy)phenyl]acetic acid Traditional Name: 2-cycloheptyl-2-[2-isobutyl-4-(2-quinolylmethoxy)phenyl]acetic acid Formula: C29H35NO3 MolecularWeight: 445.5931

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3C=C2)C(C4CCCCCC4)C(=O)O

Isomeric SMILES

CC(C)CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3C=C2)C(C4CCCCCC4)C(=O)O

InChI

InChI=1S/C29H35NO3/c1-20(2)17-23-18-25(33-19-24-14-13-21-9-7-8-12-27(21)30-24)15-16-26(23)28(29(31)32)22-10-5-3-4-6-11-22/h7-9,12-16,18,20,22,28H,3-6,10-11,17,19H2,1-2H3,(H,31,32)