7-[(E)-2-(1,2-dimethylpyrazol-1-ium-3-yl)ethenyl]-3,4-dimethyl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 7-[(E)-2-(1,2-dimethylpyrazol-1-ium-3-yl)ethenyl]-3,4-dimethyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 7-[(E)-2-(1,2-dimethylpyrazol-1-ium-3-yl)vinyl]-3,4-dimethyl-2,3-dihydro-1,4-benzoxazine CAS Name: 7-[(E)-2-(1,2-dimethyl-3-pyrazol-1-iumyl)ethenyl]-3,4-dimethyl-2,3-dihydro-1,4-benzoxazine IUPAC Name: 7-[(E)-2-(1,2-dimethylpyrazol-1-ium-3-yl)ethenyl]-3,4-dimethyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 7-[(E)-2-(1,2-dimethylpyrazol-1-ium-3-yl)vinyl]-3,4-dimethyl-2,3-dihydro-1,4-benzoxazine Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC1COC2=C(N1C)C=CC(=C2)C=CC3=CC=[N+](N3C)C

Isomeric SMILES

CC1COC2=C(N1C)C=CC(=C2)/C=C/C3=CC=[N+](N3C)C

InChI

InChI=1S/C17H22N3O/c1-13-12-21-17-11-14(6-8-16(17)19(13)3)5-7-15-9-10-18(2)20(15)4/h5-11,13H,12H2,1-4H3/q+1