2,2-diethyl-4-[[2-(hydroxymethyl)phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 2,2-diethyl-4-[[2-(hydroxymethyl)phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 2,2-diethyl-4-[2-(hydroxymethyl)anilino]-4-oxo-butanoic acid CAS Name: 2,2-diethyl-4-[2-(hydroxymethyl)anilino]-4-oxobutanoic acid IUPAC Name: 2,2-diethyl-4-[2-(hydroxymethyl)anilino]-4-oxobutanoic acid Traditional Name: 2,2-diethyl-4-keto-4-(2-methylolanilino)butyric acid Formula: C15H21NO4 MolecularWeight: 279.33154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(=O)NC1=CC=CC=C1CO)C(=O)O

Isomeric SMILES

CCC(CC)(CC(=O)NC1=CC=CC=C1CO)C(=O)O

InChI

InChI=1S/C15H21NO4/c1-3-15(4-2,14(19)20)9-13(18)16-12-8-6-5-7-11(12)10-17/h5-8,17H,3-4,9-10H2,1-2H3,(H,16,18)(H,19,20)