5-[(3-methylphenyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(3-methylphenyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(3-methylanilino)-5-oxo-pentanoic acid CAS Name: 5-(3-methylanilino)-5-oxopentanoic acid IUPAC Name: 5-(3-methylanilino)-5-oxopentanoic acid Traditional Name: 5-keto-5-(m-toluidino)valeric acid Formula: C12H15NO3 MolecularWeight: 221.2524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CCCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CCCC(=O)O

InChI

InChI=1S/C12H15NO3/c1-9-4-2-5-10(8-9)13-11(14)6-3-7-12(15)16/h2,4-5,8H,3,6-7H2,1H3,(H,13,14)(H,15,16)