2-methyl-3-phenyl-4a,5,6,7,8,8a-hexahydro-1,3-benzoxazin-3-ium-4-one

Systemtic Name: 2-methyl-3-phenyl-4a,5,6,7,8,8a-hexahydro-1,3-benzoxazin-3-ium-4-one Openeye Name: 2-methyl-3-phenyl-4a,5,6,7,8,8a-hexahydro-1,3-benzoxazin-3-ium-4-one CAS Name: 2-methyl-3-phenyl-4a,5,6,7,8,8a-hexahydro-1,3-benzoxazin-3-ium-4-one IUPAC Name: 2-methyl-3-phenyl-4a,5,6,7,8,8a-hexahydro-1,3-benzoxazin-3-ium-4-one Traditional Name: 2-methyl-3-phenyl-4a,5,6,7,8,8a-hexahydro-1,3-benzoxazin-3-ium-4-one Formula: C15H18NO2+ MolecularWeight: 244.30892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=O)C2CCCCC2O1)C3=CC=CC=C3

Isomeric SMILES

CC1=[N+](C(=O)C2CCCCC2O1)C3=CC=CC=C3

InChI

InChI=1S/C15H18NO2/c1-11-16(12-7-3-2-4-8-12)15(17)13-9-5-6-10-14(13)18-11/h2-4,7-8,13-14H,5-6,9-10H2,1H3/q+1