4-[(E)-2-[1-(2-azanylethyl)-6-methoxy-quinolin-1-ium-2-yl]ethenyl]-N,N-dibutyl-aniline

Systemtic Name: 4-[(E)-2-[1-(2-azanylethyl)-6-methoxy-quinolin-1-ium-2-yl]ethenyl]-N,N-dibutyl-aniline Openeye Name: 4-[(E)-2-[1-(2-aminoethyl)-6-methoxy-quinolin-1-ium-2-yl]vinyl]-N,N-dibutyl-aniline CAS Name: 4-[(E)-2-[1-(2-aminoethyl)-6-methoxy-2-quinolin-1-iumyl]ethenyl]-N,N-dibutylaniline IUPAC Name: 4-[(E)-2-[1-(2-aminoethyl)-6-methoxyquinolin-1-ium-2-yl]ethenyl]-N,N-dibutylaniline Traditional Name: [4-[(E)-2-[1-(2-aminoethyl)-6-methoxy-quinolin-1-ium-2-yl]vinyl]phenyl]-dibutyl-amine Formula: C28H38N3O+ MolecularWeight: 432.62082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC=C(C=C1)C=CC2=[N+](C3=C(C=C2)C=C(C=C3)OC)CCN

Isomeric SMILES

CCCCN(CCCC)C1=CC=C(C=C1)/C=C/C2=[N+](C3=C(C=C2)C=C(C=C3)OC)CCN

InChI

InChI=1S/C28H38N3O/c1-4-6-19-30(20-7-5-2)25-12-8-23(9-13-25)10-14-26-15-11-24-22-27(32-3)16-17-28(24)31(26)21-18-29/h8-17,22H,4-7,18-21,29H2,1-3H3/q+1