[3,5-dimethoxy-2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl] dihydrogen phosphate

Systemtic Name: [3,5-dimethoxy-2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl] dihydrogen phosphate Openeye Name: [3,5-dimethoxy-2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl] dihydrogen phosphate CAS Name: [3,5-dimethoxy-2-[(E)-3-[4-(methylthio)phenyl]-1-oxoprop-2-enyl]phenyl] dihydrogen phosphate IUPAC Name: [3,5-dimethoxy-2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl] dihydrogen phosphate Traditional Name: [3,5-dimethoxy-2-[(E)-3-[4-(methylthio)phenyl]acryloyl]phenyl] dihydrogen phosphate Formula: C18H19O7PS MolecularWeight: 410.378021

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OP(=O)(O)O)C(=O)C=CC2=CC=C(C=C2)SC)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OP(=O)(O)O)C(=O)/C=C/C2=CC=C(C=C2)SC)OC

InChI

InChI=1S/C18H19O7PS/c1-23-13-10-16(24-2)18(17(11-13)25-26(20,21)22)15(19)9-6-12-4-7-14(27-3)8-5-12/h4-11H,1-3H3,(H2,20,21,22)/b9-6+