(3E)-5,7-dimethyl-3-[(3,4,5-trimethoxyphenyl)methylidene]-2H-1,3-benzoxazol-3-ium

Systemtic Name: (3E)-5,7-dimethyl-3-[(3,4,5-trimethoxyphenyl)methylidene]-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-5,7-dimethyl-3-[(3,4,5-trimethoxyphenyl)methylene]-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-5,7-dimethyl-3-[(3,4,5-trimethoxyphenyl)methylidene]-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-5,7-dimethyl-3-[(3,4,5-trimethoxyphenyl)methylidene]-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-5,7-dimethyl-3-(3,4,5-trimethoxybenzylidene)-2H-1,3-benzoxazol-3-ium Formula: C19H22NO4+ MolecularWeight: 328.38228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)[N+](=CC3=CC(=C(C(=C3)OC)OC)OC)CO2)C

Isomeric SMILES

CC1=CC(=C2C(=C1)/[N+](=C\C3=CC(=C(C(=C3)OC)OC)OC)/CO2)C

InChI

InChI=1S/C19H22NO4/c1-12-6-13(2)18-15(7-12)20(11-24-18)10-14-8-16(21-3)19(23-5)17(9-14)22-4/h6-10H,11H2,1-5H3/q+1/b20-10-