6-butyl-8-methyl-3-phenyl-2H-1,3-benzoxazin-3-ium

Systemtic Name: 6-butyl-8-methyl-3-phenyl-2H-1,3-benzoxazin-3-ium Openeye Name: 6-butyl-8-methyl-3-phenyl-2H-1,3-benzoxazin-3-ium CAS Name: 6-butyl-8-methyl-3-phenyl-2H-1,3-benzoxazin-3-ium IUPAC Name: 6-butyl-8-methyl-3-phenyl-2H-1,3-benzoxazin-3-ium Traditional Name: 6-butyl-8-methyl-3-phenyl-2H-1,3-benzoxazin-3-ium Formula: C19H22NO+ MolecularWeight: 280.38408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C2C(=C1)C=[N+](CO2)C3=CC=CC=C3)C

Isomeric SMILES

CCCCC1=CC(=C2C(=C1)C=[N+](CO2)C3=CC=CC=C3)C

InChI

InChI=1S/C19H22NO/c1-3-4-8-16-11-15(2)19-17(12-16)13-20(14-21-19)18-9-6-5-7-10-18/h5-7,9-13H,3-4,8,14H2,1-2H3/q+1