[4-(2-iodanylethanoylamino)-2,5-dimethoxy-phenyl] thiocyanate

Systemtic Name: [4-(2-iodanylethanoylamino)-2,5-dimethoxy-phenyl] thiocyanate Openeye Name: [4-[(2-iodoacetyl)amino]-2,5-dimethoxy-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[(2-iodo-1-oxoethyl)amino]-2,5-dimethoxyphenyl] ester IUPAC Name: [4-[(2-iodoacetyl)amino]-2,5-dimethoxyphenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(2-iodoacetyl)amino]-2,5-dimethoxy-phenyl] ester Formula: C11H11IN2O3S MolecularWeight: 378.18611

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CI)OC)SC#N

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CI)OC)SC#N

InChI

InChI=1S/C11H11IN2O3S/c1-16-8-4-10(18-6-13)9(17-2)3-7(8)14-11(15)5-12/h3-4H,5H2,1-2H3,(H,14,15)