4-[(E)-2-[6-(1,3-benzoxazol-2-yl)-1-methyl-quinolin-1-ium-4-yl]ethenyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[(E)-2-[6-(1,3-benzoxazol-2-yl)-1-methyl-quinolin-1-ium-4-yl]ethenyl]-N,N-dimethyl-aniline Openeye Name: 4-[(E)-2-[6-(1,3-benzoxazol-2-yl)-1-methyl-quinolin-1-ium-4-yl]vinyl]-N,N-dimethyl-aniline CAS Name: 4-[(E)-2-[6-(1,3-benzoxazol-2-yl)-1-methyl-4-quinolin-1-iumyl]ethenyl]-N,N-dimethylaniline IUPAC Name: 4-[(E)-2-[6-(1,3-benzoxazol-2-yl)-1-methylquinolin-1-ium-4-yl]ethenyl]-N,N-dimethylaniline Traditional Name: [4-[(E)-2-[6-(1,3-benzoxazol-2-yl)-1-methyl-quinolin-1-ium-4-yl]vinyl]phenyl]-dimethyl-amine Formula: C27H24N3O+ MolecularWeight: 406.49896

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC(=CC2=C(C=C1)C=CC3=CC=C(C=C3)N(C)C)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C[N+]1=C2C=CC(=CC2=C(C=C1)/C=C/C3=CC=C(C=C3)N(C)C)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C27H24N3O/c1-29(2)22-13-9-19(10-14-22)8-11-20-16-17-30(3)25-15-12-21(18-23(20)25)27-28-24-6-4-5-7-26(24)31-27/h4-18H,1-3H3/q+1