1-adamantyl-[2-oxidanylidene-2-[[(1R)-1-(4-sulfamoylphenyl)ethyl]amino]ethyl]azanium

Systemtic Name: 1-adamantyl-[2-oxidanylidene-2-[[(1R)-1-(4-sulfamoylphenyl)ethyl]amino]ethyl]azanium Openeye Name: 1-adamantyl-[2-oxo-2-[[(1R)-1-(4-sulfamoylphenyl)ethyl]amino]ethyl]ammonium CAS Name: 1-adamantyl-[2-oxo-2-[[(1R)-1-(4-sulfamoylphenyl)ethyl]amino]ethyl]ammonium IUPAC Name: 1-adamantyl-[2-oxo-2-[[(1R)-1-(4-sulfamoylphenyl)ethyl]amino]ethyl]azanium Traditional Name: 1-adamantyl-[2-keto-2-[[(1R)-1-(4-sulfamoylphenyl)ethyl]amino]ethyl]ammonium Formula: C20H30N3O3S+ MolecularWeight: 392.5355

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H29N3O3S/c1-13(17-2-4-18(5-3-17)27(21,25)26)23-19(24)12-22-20-9-14-6-15(10-20)8-16(7-14)11-20/h2-5,13-16,22H,6-12H2,1H3,(H,23,24)(H2,21,25,26)/p+1/t13-,14?,15?,16?,20?/m1/s1