1-adamantyl-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-(3-methylsulfonylanilino)-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-(3-methylsulfonylanilino)-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-(3-methylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-keto-2-(3-mesylanilino)ethyl]ammonium Formula: C19H27N2O3S+ MolecularWeight: 363.49428

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H26N2O3S/c1-25(23,24)17-4-2-3-16(8-17)21-18(22)12-20-19-9-13-5-14(10-19)7-15(6-13)11-19/h2-4,8,13-15,20H,5-7,9-12H2,1H3,(H,21,22)/p+1