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

Systemtic Name: 2-[1-phenethyl-5-(quinolin-2-ylmethoxy)indol-3-yl]ethanoic acid Openeye Name: 2-[1-phenethyl-5-(2-quinolylmethoxy)indol-3-yl]acetic acid CAS Name: 2-[1-phenethyl-5-(2-quinolinylmethoxy)-3-indolyl]acetic acid IUPAC Name: 2-[1-phenethyl-5-(quinolin-2-ylmethoxy)indol-3-yl]acetic acid Traditional Name: 2-[1-phenethyl-5-(2-quinolylmethoxy)indol-3-yl]acetic acid Formula: C28H24N2O3 MolecularWeight: 436.50176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C=C(C3=C2C=CC(=C3)OCC4=NC5=CC=CC=C5C=C4)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCN2C=C(C3=C2C=CC(=C3)OCC4=NC5=CC=CC=C5C=C4)CC(=O)O

InChI

InChI=1S/C28H24N2O3/c31-28(32)16-22-18-30(15-14-20-6-2-1-3-7-20)27-13-12-24(17-25(22)27)33-19-23-11-10-21-8-4-5-9-26(21)29-23/h1-13,17-18H,14-16,19H2,(H,31,32)