1-[4-methyl-2-oxidanyl-4-(phenylmethyl)-1,4-benzoxazin-4-ium-3-yl]ethanone

Systemtic Name: 1-[4-methyl-2-oxidanyl-4-(phenylmethyl)-1,4-benzoxazin-4-ium-3-yl]ethanone Openeye Name: 1-(4-benzyl-2-hydroxy-4-methyl-1,4-benzoxazin-4-ium-3-yl)ethanone CAS Name: 1-[2-hydroxy-4-methyl-4-(phenylmethyl)-1,4-benzoxazin-4-ium-3-yl]ethanone IUPAC Name: 1-(4-benzyl-2-hydroxy-4-methyl-1,4-benzoxazin-4-ium-3-yl)ethanone Traditional Name: 1-(4-benzyl-2-hydroxy-4-methyl-1,4-benzoxazin-4-ium-3-yl)ethanone Formula: C18H18NO3+ MolecularWeight: 296.34042

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(OC2=CC=CC=C2[N+]1(C)CC3=CC=CC=C3)O

Isomeric SMILES

CC(=O)C1=C(OC2=CC=CC=C2[N+]1(C)CC3=CC=CC=C3)O

InChI

InChI=1S/C18H17NO3/c1-13(20)17-18(21)22-16-11-7-6-10-15(16)19(17,2)12-14-8-4-3-5-9-14/h3-11H,12H2,1-2H3/p+1