3-(cyclohexylmethyl)-8-methyl-1,3-benzoxazin-3-ium-2-one

Systemtic Name: 3-(cyclohexylmethyl)-8-methyl-1,3-benzoxazin-3-ium-2-one Openeye Name: 3-(cyclohexylmethyl)-8-methyl-1,3-benzoxazin-3-ium-2-one CAS Name: 3-(cyclohexylmethyl)-8-methyl-1,3-benzoxazin-3-ium-2-one IUPAC Name: 3-(cyclohexylmethyl)-8-methyl-1,3-benzoxazin-3-ium-2-one Traditional Name: 3-(cyclohexylmethyl)-8-methyl-1,3-benzoxazin-3-ium-2-one Formula: C16H20NO2+ MolecularWeight: 258.3355

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC(=O)[N+](=C2)CC3CCCCC3

Isomeric SMILES

CC1=CC=CC2=C1OC(=O)[N+](=C2)CC3CCCCC3

InChI

InChI=1S/C16H20NO2/c1-12-6-5-9-14-11-17(16(18)19-15(12)14)10-13-7-3-2-4-8-13/h5-6,9,11,13H,2-4,7-8,10H2,1H3/q+1