1-adamantyl-[2-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-oxo-2-[[3-(p-tolyl)isoxazol-5-yl]amino]ethyl]ammonium CAS Name: 1-adamantyl-[2-[[3-(4-methylphenyl)-5-isoxazolyl]amino]-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-keto-2-[[3-(p-tolyl)isoxazol-5-yl]amino]ethyl]ammonium Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2)NC(=O)C[NH2+]C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2)NC(=O)C[NH2+]C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3O2/c1-14-2-4-18(5-3-14)19-9-21(27-25-19)24-20(26)13-23-22-10-15-6-16(11-22)8-17(7-15)12-22/h2-5,9,15-17,23H,6-8,10-13H2,1H3,(H,24,26)/p+1