2-[4-[(2-methoxyphenyl)amino]-4-oxidanylidene-butan-2-yl]hexanoic acid

Systemtic Name: 2-[4-[(2-methoxyphenyl)amino]-4-oxidanylidene-butan-2-yl]hexanoic acid Openeye Name: 2-[3-(2-methoxyanilino)-1-methyl-3-oxo-propyl]hexanoic acid CAS Name: 2-[4-(2-methoxyanilino)-4-oxobutan-2-yl]hexanoic acid IUPAC Name: 2-[4-(2-methoxyanilino)-4-oxobutan-2-yl]hexanoic acid Traditional Name: 2-[3-keto-1-methyl-3-(o-anisidino)propyl]hexanoic acid Formula: C17H25NO4 MolecularWeight: 307.3847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)CC(=O)NC1=CC=CC=C1OC)C(=O)O

Isomeric SMILES

CCCCC(C(C)CC(=O)NC1=CC=CC=C1OC)C(=O)O

InChI

InChI=1S/C17H25NO4/c1-4-5-8-13(17(20)21)12(2)11-16(19)18-14-9-6-7-10-15(14)22-3/h6-7,9-10,12-13H,4-5,8,11H2,1-3H3,(H,18,19)(H,20,21)