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

Systemtic Name: 2-[1-hexyl-2-methyl-5-(quinolin-2-ylmethoxy)indol-3-yl]ethanoic acid Openeye Name: 2-[1-hexyl-2-methyl-5-(2-quinolylmethoxy)indol-3-yl]acetic acid CAS Name: 2-[1-hexyl-2-methyl-5-(2-quinolinylmethoxy)-3-indolyl]acetic acid IUPAC Name: 2-[1-hexyl-2-methyl-5-(quinolin-2-ylmethoxy)indol-3-yl]acetic acid Traditional Name: 2-[1-hexyl-2-methyl-5-(2-quinolylmethoxy)indol-3-yl]acetic acid Formula: C27H30N2O3 MolecularWeight: 430.5387

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=C1C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)CC(=O)O)C

Isomeric SMILES

CCCCCCN1C(=C(C2=C1C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)CC(=O)O)C

InChI

InChI=1S/C27H30N2O3/c1-3-4-5-8-15-29-19(2)23(17-27(30)31)24-16-22(13-14-26(24)29)32-18-21-12-11-20-9-6-7-10-25(20)28-21/h6-7,9-14,16H,3-5,8,15,17-18H2,1-2H3,(H,30,31)