2-[6-methoxy-2-[(E)-2-(3-phenoxyphenyl)ethenyl]quinolin-1-ium-1-yl]ethanamine

Systemtic Name: 2-[6-methoxy-2-[(E)-2-(3-phenoxyphenyl)ethenyl]quinolin-1-ium-1-yl]ethanamine Openeye Name: 2-[6-methoxy-2-[(E)-2-(3-phenoxyphenyl)vinyl]quinolin-1-ium-1-yl]ethanamine CAS Name: 2-[6-methoxy-2-[(E)-2-(3-phenoxyphenyl)ethenyl]-1-quinolin-1-iumyl]ethanamine IUPAC Name: 2-[6-methoxy-2-[(E)-2-(3-phenoxyphenyl)ethenyl]quinolin-1-ium-1-yl]ethanamine Traditional Name: 2-[6-methoxy-2-[(E)-2-(3-phenoxyphenyl)vinyl]quinolin-1-ium-1-yl]ethylamine Formula: C26H25N2O2+ MolecularWeight: 397.4889

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)[N+](=C(C=C2)C=CC3=CC(=CC=C3)OC4=CC=CC=C4)CCN

Isomeric SMILES

COC1=CC2=C(C=C1)[N+](=C(C=C2)/C=C/C3=CC(=CC=C3)OC4=CC=CC=C4)CCN

InChI

InChI=1S/C26H25N2O2/c1-29-24-14-15-26-21(19-24)11-13-22(28(26)17-16-27)12-10-20-6-5-9-25(18-20)30-23-7-3-2-4-8-23/h2-15,18-19H,16-17,27H2,1H3/q+1/b12-10+