2-methoxy-N-[(1E,3E)-4-(1-methylquinolin-1-ium-2-yl)buta-1,3-dienyl]aniline perchlorate

Systemtic Name: 2-methoxy-N-[(1E,3E)-4-(1-methylquinolin-1-ium-2-yl)buta-1,3-dienyl]aniline perchlorate Openeye Name: 2-methoxy-N-[(1E,3E)-4-(1-methylquinolin-1-ium-2-yl)buta-1,3-dienyl]aniline perchlorate CAS Name: 2-methoxy-N-[(1E,3E)-4-(1-methyl-2-quinolin-1-iumyl)buta-1,3-dienyl]aniline perchlorate IUPAC Name: 2-methoxy-N-[(1E,3E)-4-(1-methylquinolin-1-ium-2-yl)buta-1,3-dienyl]aniline perchlorate Traditional Name: (2-methoxyphenyl)-[(1E,3E)-4-(1-methylquinolin-1-ium-2-yl)buta-1,3-dienyl]amine perchlorate Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC2=CC=CC=C21)C=CC=CNC3=CC=CC=C3OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=C(C=CC2=CC=CC=C21)/C=C/C=C/NC3=CC=CC=C3OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H20N2O.ClHO4/c1-23-18(15-14-17-9-3-5-12-20(17)23)10-7-8-16-22-19-11-4-6-13-21(19)24-2;2-1(3,4)5/h3-16H,1-2H3;(H,2,3,4,5)