4-[2-[ethyl(2-methylprop-2-enyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 4-[2-[ethyl(2-methylprop-2-enyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 4-[2-[ethyl(2-methylallyl)amino]-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 4-[[2-[ethyl(2-methylprop-2-enyl)amino]-2-oxoethyl]thio]benzoic acid IUPAC Name: 4-[2-[ethyl(2-methylprop-2-enyl)amino]-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 4-[[2-[ethyl(2-methylallyl)amino]-2-keto-ethyl]thio]benzoic acid Formula: C15H19NO3S MolecularWeight: 293.38126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)C(=O)CSC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCN(CC(=C)C)C(=O)CSC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C15H19NO3S/c1-4-16(9-11(2)3)14(17)10-20-13-7-5-12(6-8-13)15(18)19/h5-8H,2,4,9-10H2,1,3H3,(H,18,19)