5-[[4-(2,5-dimethylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[4-(2,5-dimethylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(2,5-dimethylphenoxy)anilino]-5-oxo-pentanoic acid CAS Name: 5-[4-(2,5-dimethylphenoxy)anilino]-5-oxopentanoic acid IUPAC Name: 5-[4-(2,5-dimethylphenoxy)anilino]-5-oxopentanoic acid Traditional Name: 5-[4-(2,5-dimethylphenoxy)anilino]-5-keto-valeric acid Formula: C19H21NO4 MolecularWeight: 327.37434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=CC=C(C=C2)NC(=O)CCCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=CC=C(C=C2)NC(=O)CCCC(=O)O

InChI

InChI=1S/C19H21NO4/c1-13-6-7-14(2)17(12-13)24-16-10-8-15(9-11-16)20-18(21)4-3-5-19(22)23/h6-12H,3-5H2,1-2H3,(H,20,21)(H,22,23)