2-[2-[[2,6-di(propan-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[[2,6-di(propan-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(2,6-diisopropylanilino)-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-(2,6-diisopropylanilino)-2-keto-ethyl]thio]acetic acid Formula: C16H23NO3S MolecularWeight: 309.42372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CSCC(=O)O

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CSCC(=O)O

InChI

InChI=1S/C16H23NO3S/c1-10(2)12-6-5-7-13(11(3)4)16(12)17-14(18)8-21-9-15(19)20/h5-7,10-11H,8-9H2,1-4H3,(H,17,18)(H,19,20)