[2-[2-(3,4-dimethoxyphenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-methylsulfonylbenzoate

Systemtic Name: [2-[2-(3,4-dimethoxyphenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-methylsulfonylbenzoate Openeye Name: [2-[2-(3,4-dimethoxybenzoyl)hydrazino]-2-oxo-ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [2-[[(3,4-dimethoxyphenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(3,4-dimethoxybenzoyl)hydrazinyl]-2-oxoethyl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-keto-2-(N'-veratroylhydrazino)ethyl] ester Formula: C19H20N2O8S MolecularWeight: 436.4357

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)C)OC

InChI

InChI=1S/C19H20N2O8S/c1-27-15-8-7-12(10-16(15)28-2)18(23)21-20-17(22)11-29-19(24)13-5-4-6-14(9-13)30(3,25)26/h4-10H,11H2,1-3H3,(H,20,22)(H,21,23)