2-[5-methoxy-2-methyl-1-(2-methylpropyl)indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-methoxy-2-methyl-1-(2-methylpropyl)indol-3-yl]ethanoic acid Openeye Name: 2-(1-isobutyl-5-methoxy-2-methyl-indol-3-yl)acetic acid CAS Name: 2-[5-methoxy-2-methyl-1-(2-methylpropyl)-3-indolyl]acetic acid IUPAC Name: 2-[5-methoxy-2-methyl-1-(2-methylpropyl)indol-3-yl]acetic acid Traditional Name: 2-(1-isobutyl-5-methoxy-2-methyl-indol-3-yl)acetic acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(C)C)C=CC(=C2)OC)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC(C)C)C=CC(=C2)OC)CC(=O)O

InChI

InChI=1S/C16H21NO3/c1-10(2)9-17-11(3)13(8-16(18)19)14-7-12(20-4)5-6-15(14)17/h5-7,10H,8-9H2,1-4H3,(H,18,19)