4-[(2-tert-butylphenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2-tert-butylphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-tert-butylanilino)-4-oxo-butanoic acid CAS Name: 4-(2-tert-butylanilino)-4-oxobutanoic acid IUPAC Name: 4-(2-tert-butylanilino)-4-oxobutanoic acid Traditional Name: 4-(2-tert-butylanilino)-4-keto-butyric acid Formula: C14H19NO3 MolecularWeight: 249.30556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NC(=O)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NC(=O)CCC(=O)O

InChI

InChI=1S/C14H19NO3/c1-14(2,3)10-6-4-5-7-11(10)15-12(16)8-9-13(17)18/h4-7H,8-9H2,1-3H3,(H,15,16)(H,17,18)