methyl-[[3-(oxan-4-ylcarbamoyl)-1,2-oxazol-5-yl]methyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[[3-(oxan-4-ylcarbamoyl)-1,2-oxazol-5-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[[3-(tetrahydropyran-4-ylcarbamoyl)isoxazol-5-yl]methyl]ammonium CAS Name: methyl-[[3-[(4-oxanylamino)-oxomethyl]-5-isoxazolyl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[[3-(oxan-4-ylcarbamoyl)-1,2-oxazol-5-yl]methyl]azanium Traditional Name: benzyl-methyl-[[3-(tetrahydropyran-4-ylcarbamoyl)isoxazol-5-yl]methyl]ammonium Formula: C18H24N3O3+ MolecularWeight: 330.40146

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=CC(=NO2)C(=O)NC3CCOCC3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=CC(=NO2)C(=O)NC3CCOCC3

InChI

InChI=1S/C18H23N3O3/c1-21(12-14-5-3-2-4-6-14)13-16-11-17(20-24-16)18(22)19-15-7-9-23-10-8-15/h2-6,11,15H,7-10,12-13H2,1H3,(H,19,22)/p+1