[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 3-[methyl(propan-2-yl)sulfamoyl]benzoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 3-[methyl(propan-2-yl)sulfamoyl]benzoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 3-[isopropyl(methyl)sulfamoyl]benzoate CAS Name: 3-[methyl(propan-2-yl)sulfamoyl]benzoic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 3-[methyl(propan-2-yl)sulfamoyl]benzoate Traditional Name: 3-[isopropyl(methyl)sulfamoyl]benzoic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C23H32N2O5S MolecularWeight: 448.57558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)N(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H32N2O5S/c1-15(2)25(3)31(28,29)20-6-4-5-19(10-20)22(27)30-14-21(26)24-23-11-16-7-17(12-23)9-18(8-16)13-23/h4-6,10,15-18H,7-9,11-14H2,1-3H3,(H,24,26)