(3S)-5-[(3-chloranyl-4-methoxy-phenyl)amino]-3-ethyl-3-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: (3S)-5-[(3-chloranyl-4-methoxy-phenyl)amino]-3-ethyl-3-methyl-5-oxidanylidene-pentanoic acid Openeye Name: (3S)-5-(3-chloro-4-methoxy-anilino)-3-ethyl-3-methyl-5-oxo-pentanoic acid CAS Name: (3S)-5-(3-chloro-4-methoxyanilino)-3-ethyl-3-methyl-5-oxopentanoic acid IUPAC Name: (3S)-5-(3-chloro-4-methoxyanilino)-3-ethyl-3-methyl-5-oxopentanoic acid Traditional Name: (3S)-5-(3-chloro-4-methoxy-anilino)-3-ethyl-5-keto-3-methyl-valeric acid Formula: C15H20ClNO4 MolecularWeight: 313.7766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(=O)NC1=CC(=C(C=C1)OC)Cl)CC(=O)O

Isomeric SMILES

CC[C@@](C)(CC(=O)NC1=CC(=C(C=C1)OC)Cl)CC(=O)O

InChI

InChI=1S/C15H20ClNO4/c1-4-15(2,9-14(19)20)8-13(18)17-10-5-6-12(21-3)11(16)7-10/h5-7H,4,8-9H2,1-3H3,(H,17,18)(H,19,20)/t15-/m0/s1