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

Systemtic Name: [3-(2-cyclopentyl-2-phenyl-ethanoyl)-2,6-di(propan-2-yl)phenyl] sulfamate Openeye Name: [3-(2-cyclopentyl-2-phenyl-acetyl)-2,6-diisopropyl-phenyl] sulfamate CAS Name: sulfamic acid [3-(2-cyclopentyl-1-oxo-2-phenylethyl)-2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [3-(2-cyclopentyl-2-phenylacetyl)-2,6-di(propan-2-yl)phenyl] sulfamate Traditional Name: sulfamic acid [3-(2-cyclopentyl-2-phenyl-acetyl)-2,6-diisopropyl-phenyl] ester Formula: C25H33NO4S MolecularWeight: 443.59882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(C=C1)C(=O)C(C2CCCC2)C3=CC=CC=C3)C(C)C)OS(=O)(=O)N

Isomeric SMILES

CC(C)C1=C(C(=C(C=C1)C(=O)C(C2CCCC2)C3=CC=CC=C3)C(C)C)OS(=O)(=O)N

InChI

InChI=1S/C25H33NO4S/c1-16(2)20-14-15-21(22(17(3)4)25(20)30-31(26,28)29)24(27)23(19-12-8-9-13-19)18-10-6-5-7-11-18/h5-7,10-11,14-17,19,23H,8-9,12-13H2,1-4H3,(H2,26,28,29)