[3-(2-cyclohexyl-2-phenyl-ethanoyl)-2,6-di(propan-2-yl)phenyl] sulfamate

Systemtic Name: [3-(2-cyclohexyl-2-phenyl-ethanoyl)-2,6-di(propan-2-yl)phenyl] sulfamate Openeye Name: [3-(2-cyclohexyl-2-phenyl-acetyl)-2,6-diisopropyl-phenyl] sulfamate CAS Name: sulfamic acid [3-(2-cyclohexyl-1-oxo-2-phenylethyl)-2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [3-(2-cyclohexyl-2-phenylacetyl)-2,6-di(propan-2-yl)phenyl] sulfamate Traditional Name: sulfamic acid [3-(2-cyclohexyl-2-phenyl-acetyl)-2,6-diisopropyl-phenyl] ester Formula: C26H35NO4S MolecularWeight: 457.6254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(C=C1)C(=O)C(C2CCCCC2)C3=CC=CC=C3)C(C)C)OS(=O)(=O)N

Isomeric SMILES

CC(C)C1=C(C(=C(C=C1)C(=O)C(C2CCCCC2)C3=CC=CC=C3)C(C)C)OS(=O)(=O)N

InChI

InChI=1S/C26H35NO4S/c1-17(2)21-15-16-22(23(18(3)4)26(21)31-32(27,29)30)25(28)24(19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5,7-8,11-12,15-18,20,24H,6,9-10,13-14H2,1-4H3,(H2,27,29,30)