1-adamantylmethyl 4-(methylsulfonylamino)benzoate

Systemtic Name: 1-adamantylmethyl 4-(methylsulfonylamino)benzoate Openeye Name: 1-adamantylmethyl 4-(methanesulfonamido)benzoate CAS Name: 4-(methanesulfonamido)benzoic acid 1-adamantylmethyl ester IUPAC Name: 1-adamantylmethyl 4-(methanesulfonamido)benzoate Traditional Name: 4-(methanesulfonamido)benzoic acid 1-adamantylmethyl ester Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)OCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)OCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H25NO4S/c1-25(22,23)20-17-4-2-16(3-5-17)18(21)24-12-19-9-13-6-14(10-19)8-15(7-13)11-19/h2-5,13-15,20H,6-12H2,1H3