2-[(E)-2-(5-methoxy-1H-indol-3-yl)ethenyl]-3-methyl-1,3-benzoxazol-3-ium iodide

Systemtic Name: 2-[(E)-2-(5-methoxy-1H-indol-3-yl)ethenyl]-3-methyl-1,3-benzoxazol-3-ium iodide Openeye Name: 2-[(E)-2-(5-methoxy-1H-indol-3-yl)vinyl]-3-methyl-1,3-benzoxazol-3-ium iodide CAS Name: 2-[(E)-2-(5-methoxy-1H-indol-3-yl)ethenyl]-3-methyl-1,3-benzoxazol-3-ium iodide IUPAC Name: 2-[(E)-2-(5-methoxy-1H-indol-3-yl)ethenyl]-3-methyl-1,3-benzoxazol-3-ium iodide Traditional Name: 2-[(E)-2-(5-methoxy-1H-indol-3-yl)vinyl]-3-methyl-1,3-benzoxazol-3-ium iodide Formula: C19H17IN2O2 MolecularWeight: 432.25495

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(OC2=CC=CC=C21)C=CC3=CNC4=C3C=C(C=C4)OC.[I-]

Isomeric SMILES

C[N+]1=C(OC2=CC=CC=C21)/C=C/C3=CNC4=C3C=C(C=C4)OC.[I-]

InChI

InChI=1S/C19H16N2O2.HI/c1-21-17-5-3-4-6-18(17)23-19(21)10-7-13-12-20-16-9-8-14(22-2)11-15(13)16;/h3-12H,1-2H3;1H