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

Systemtic Name: 3-(cyclohexylmethyl)-8-(2-phenylpropan-2-yl)-1,3-benzoxazin-3-ium-2-one Openeye Name: 3-(cyclohexylmethyl)-8-(1-methyl-1-phenyl-ethyl)-1,3-benzoxazin-3-ium-2-one CAS Name: 3-(cyclohexylmethyl)-8-(2-phenylpropan-2-yl)-1,3-benzoxazin-3-ium-2-one IUPAC Name: 3-(cyclohexylmethyl)-8-(2-phenylpropan-2-yl)-1,3-benzoxazin-3-ium-2-one Traditional Name: 8-cumyl-3-(cyclohexylmethyl)-1,3-benzoxazin-3-ium-2-one Formula: C24H28NO2+ MolecularWeight: 362.48462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=CC3=C2OC(=O)[N+](=C3)CC4CCCCC4

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=CC3=C2OC(=O)[N+](=C3)CC4CCCCC4

InChI

InChI=1S/C24H28NO2/c1-24(2,20-13-7-4-8-14-20)21-15-9-12-19-17-25(23(26)27-22(19)21)16-18-10-5-3-6-11-18/h4,7-9,12-15,17-18H,3,5-6,10-11,16H2,1-2H3/q+1