2-[1-heptyl-2-methyl-5-(quinolin-2-ylmethoxy)indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-heptyl-2-methyl-5-(quinolin-2-ylmethoxy)indol-3-yl]ethanoic acid Openeye Name: 2-[1-heptyl-2-methyl-5-(2-quinolylmethoxy)indol-3-yl]acetic acid CAS Name: 2-[1-heptyl-2-methyl-5-(2-quinolinylmethoxy)-3-indolyl]acetic acid IUPAC Name: 2-[1-heptyl-2-methyl-5-(quinolin-2-ylmethoxy)indol-3-yl]acetic acid Traditional Name: 2-[1-heptyl-2-methyl-5-(2-quinolylmethoxy)indol-3-yl]acetic acid Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=C(C2=C1C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)CC(=O)O)C

Isomeric SMILES

CCCCCCCN1C(=C(C2=C1C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)CC(=O)O)C

InChI

InChI=1S/C28H32N2O3/c1-3-4-5-6-9-16-30-20(2)24(18-28(31)32)25-17-23(14-15-27(25)30)33-19-22-13-12-21-10-7-8-11-26(21)29-22/h7-8,10-15,17H,3-6,9,16,18-19H2,1-2H3,(H,31,32)