[2-(aminomethyl)-4-tert-butyl-6-iodanyl-phenyl] N-phenylsulfamate hydrochloride

Systemtic Name: [2-(aminomethyl)-4-tert-butyl-6-iodanyl-phenyl] N-phenylsulfamate hydrochloride Openeye Name: [2-(aminomethyl)-4-tert-butyl-6-iodo-phenyl] N-phenylsulfamate hydrochloride CAS Name: N-phenylsulfamic acid [2-(aminomethyl)-4-tert-butyl-6-iodophenyl] ester hydrochloride IUPAC Name: [2-(aminomethyl)-4-tert-butyl-6-iodophenyl] N-phenylsulfamate hydrochloride Traditional Name: N-phenylsulfamic acid [2-(aminomethyl)-4-tert-butyl-6-iodo-phenyl] ester hydrochloride Formula: C17H22ClIN2O3S MolecularWeight: 496.79065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)I)OS(=O)(=O)NC2=CC=CC=C2)CN.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)I)OS(=O)(=O)NC2=CC=CC=C2)CN.Cl

InChI

InChI=1S/C17H21IN2O3S.ClH/c1-17(2,3)13-9-12(11-19)16(15(18)10-13)23-24(21,22)20-14-7-5-4-6-8-14;/h4-10,20H,11,19H2,1-3H3;1H