[2-oxidanylidene-2-(prop-2-enylamino)ethyl] 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylamino)ethyl] 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoate Openeye Name: [2-(allylamino)-2-oxo-ethyl] 4-[[(E)-styryl]sulfonylamino]benzoate CAS Name: 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoic acid [2-oxo-2-(prop-2-enylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylamino)ethyl] 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoate Traditional Name: 4-[[(E)-styryl]sulfonylamino]benzoic acid [2-(allylamino)-2-keto-ethyl] ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

C=CCNC(=O)COC(=O)C1=CC=C(C=C1)NS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H20N2O5S/c1-2-13-21-19(23)15-27-20(24)17-8-10-18(11-9-17)22-28(25,26)14-12-16-6-4-3-5-7-16/h2-12,14,22H,1,13,15H2,(H,21,23)/b14-12+