5-[3-ethyl-4-(1-methoxypropan-2-ylamino)-5-methyl-phenoxy]pentanoic acid

Systemtic Name: 5-[3-ethyl-4-(1-methoxypropan-2-ylamino)-5-methyl-phenoxy]pentanoic acid Openeye Name: 5-[3-ethyl-4-[(2-methoxy-1-methyl-ethyl)amino]-5-methyl-phenoxy]pentanoic acid CAS Name: 5-[3-ethyl-4-(1-methoxypropan-2-ylamino)-5-methylphenoxy]pentanoic acid IUPAC Name: 5-[3-ethyl-4-(1-methoxypropan-2-ylamino)-5-methylphenoxy]pentanoic acid Traditional Name: 5-[3-ethyl-4-[(2-methoxy-1-methyl-ethyl)amino]-5-methyl-phenoxy]valeric acid Formula: C18H29NO4 MolecularWeight: 323.42716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)OCCCCC(=O)O)C)NC(C)COC

Isomeric SMILES

CCC1=C(C(=CC(=C1)OCCCCC(=O)O)C)NC(C)COC

InChI

InChI=1S/C18H29NO4/c1-5-15-11-16(23-9-7-6-8-17(20)21)10-13(2)18(15)19-14(3)12-22-4/h10-11,14,19H,5-9,12H2,1-4H3,(H,20,21)