5-[1-(2-methoxy-5-methyl-phenyl)ethylamino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[1-(2-methoxy-5-methyl-phenyl)ethylamino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[1-(2-methoxy-5-methyl-phenyl)ethylamino]-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-[1-(2-methoxy-5-methylphenyl)ethylamino]-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-[1-(2-methoxy-5-methylphenyl)ethylamino]-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-keto-5-[1-(2-methoxy-5-methyl-phenyl)ethylamino]-3,3-dimethyl-valeric acid Formula: C17H25NO4 MolecularWeight: 307.3847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)NC(=O)CC(C)(C)CC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(C)NC(=O)CC(C)(C)CC(=O)O

InChI

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