4-[[4-[(3-methylphenyl)amino]-4-oxidanylidene-butyl]amino]butanoic acid

Systemtic Name: 4-[[4-[(3-methylphenyl)amino]-4-oxidanylidene-butyl]amino]butanoic acid Openeye Name: 4-[[4-(3-methylanilino)-4-oxo-butyl]amino]butanoic acid CAS Name: 4-[[4-(3-methylanilino)-4-oxobutyl]amino]butanoic acid IUPAC Name: 4-[[4-(3-methylanilino)-4-oxobutyl]amino]butanoic acid Traditional Name: 4-[[4-keto-4-(m-toluidino)butyl]amino]butyric acid Formula: C15H22N2O3 MolecularWeight: 278.34678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3/c1-12-5-2-6-13(11-12)17-14(18)7-3-9-16-10-4-8-15(19)20/h2,5-6,11,16H,3-4,7-10H2,1H3,(H,17,18)(H,19,20)