[2-methoxy-4-[(E)-prop-1-enyl]phenyl] 5-chloranyl-1-methyl-imidazole-4-sulfonate

Systemtic Name: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] 5-chloranyl-1-methyl-imidazole-4-sulfonate Openeye Name: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] 5-chloro-1-methyl-imidazole-4-sulfonate CAS Name: 5-chloro-1-methyl-4-imidazolesulfonic acid [2-methoxy-4-[(E)-prop-1-enyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] 5-chloro-1-methylimidazole-4-sulfonate Traditional Name: 5-chloro-1-methyl-imidazole-4-sulfonic acid [2-methoxy-4-[(E)-prop-1-enyl]phenyl] ester Formula: C14H15ClN2O4S MolecularWeight: 342.7979

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC(=C(C=C1)OS(=O)(=O)C2=C(N(C=N2)C)Cl)OC

Isomeric SMILES

C/C=C/C1=CC(=C(C=C1)OS(=O)(=O)C2=C(N(C=N2)C)Cl)OC

InChI

InChI=1S/C14H15ClN2O4S/c1-4-5-10-6-7-11(12(8-10)20-3)21-22(18,19)14-13(15)17(2)9-16-14/h4-9H,1-3H3/b5-4+