2-[[4-(diethylamino)phenyl]methyl]-3-oxidanylidene-butanoic acid

Systemtic Name: 2-[[4-(diethylamino)phenyl]methyl]-3-oxidanylidene-butanoic acid Openeye Name: 2-[[4-(diethylamino)phenyl]methyl]-3-oxo-butanoic acid CAS Name: 2-[[4-(diethylamino)phenyl]methyl]-3-oxobutanoic acid IUPAC Name: 2-[[4-(diethylamino)phenyl]methyl]-3-oxobutanoic acid Traditional Name: 2-[4-(diethylamino)benzyl]-3-keto-butyric acid Formula: C15H21NO3 MolecularWeight: 263.33214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CC(C(=O)C)C(=O)O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CC(C(=O)C)C(=O)O

InChI

InChI=1S/C15H21NO3/c1-4-16(5-2)13-8-6-12(7-9-13)10-14(11(3)17)15(18)19/h6-9,14H,4-5,10H2,1-3H3,(H,18,19)