3-(6-tert-butyl-2-oxidanylidene-1H-quinolin-3-yl)propanoic acid

Systemtic Name: 3-(6-tert-butyl-2-oxidanylidene-1H-quinolin-3-yl)propanoic acid Openeye Name: 3-(6-tert-butyl-2-oxo-1H-quinolin-3-yl)propanoic acid CAS Name: 3-(6-tert-butyl-2-oxo-1H-quinolin-3-yl)propanoic acid IUPAC Name: 3-(6-tert-butyl-2-oxo-1H-quinolin-3-yl)propanoic acid Traditional Name: 3-(6-tert-butyl-2-keto-1H-quinolin-3-yl)propionic acid Formula: C16H19NO3 MolecularWeight: 273.32696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)NC(=O)C(=C2)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC(=O)C(=C2)CCC(=O)O

InChI

InChI=1S/C16H19NO3/c1-16(2,3)12-5-6-13-11(9-12)8-10(15(20)17-13)4-7-14(18)19/h5-6,8-9H,4,7H2,1-3H3,(H,17,20)(H,18,19)