4-[[2-ethoxy-4-[(ethylcarbamothioylhydrazinylidene)methyl]-6-prop-2-enyl-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[2-ethoxy-4-[(ethylcarbamothioylhydrazinylidene)methyl]-6-prop-2-enyl-phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-allyl-6-ethoxy-4-[(ethylcarbamothioylhydrazono)methyl]phenoxy]methyl]benzoic acid CAS Name: 4-[[2-ethoxy-4-[[[ethylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-6-prop-2-enylphenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-ethoxy-4-[(ethylcarbamothioylhydrazinylidene)methyl]-6-prop-2-enylphenoxy]methyl]benzoic acid Traditional Name: 4-[[2-allyl-6-ethoxy-4-[(ethylthiocarbamoylhydrazono)methyl]phenoxy]methyl]benzoic acid Formula: C23H27N3O4S MolecularWeight: 441.54318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=CC(=C(C(=C1)OCC)OCC2=CC=C(C=C2)C(=O)O)CC=C

Isomeric SMILES

CCNC(=S)NN=CC1=CC(=C(C(=C1)OCC)OCC2=CC=C(C=C2)C(=O)O)CC=C

InChI

InChI=1S/C23H27N3O4S/c1-4-7-19-12-17(14-25-26-23(31)24-5-2)13-20(29-6-3)21(19)30-15-16-8-10-18(11-9-16)22(27)28/h4,8-14H,1,5-7,15H2,2-3H3,(H,27,28)(H2,24,26,31)