cyclooctyl-[[5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]azanium

Systemtic Name: cyclooctyl-[[5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]azanium Openeye Name: cyclooctyl-[[5-(5-methyl-3-phenyl-isoxazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]ammonium CAS Name: cyclooctyl-[[5-(5-methyl-3-phenyl-4-isoxazolyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium IUPAC Name: cyclooctyl-[[5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]azanium Traditional Name: cyclooctyl-[[5-(5-methyl-3-phenyl-isoxazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]ammonium Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NN=C(O3)C[NH2+]C4CCCCCCC4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NN=C(O3)C[NH2+]C4CCCCCCC4

InChI

InChI=1S/C21H26N4O2/c1-15-19(20(25-27-15)16-10-6-5-7-11-16)21-24-23-18(26-21)14-22-17-12-8-3-2-4-9-13-17/h5-7,10-11,17,22H,2-4,8-9,12-14H2,1H3/p+1