N,N-bis(2-chloroethyl)-4-[(E)-2-(1-methylquinolin-1-ium-4-yl)ethenyl]aniline

Systemtic Name: N,N-bis(2-chloroethyl)-4-[(E)-2-(1-methylquinolin-1-ium-4-yl)ethenyl]aniline Openeye Name: N,N-bis(2-chloroethyl)-4-[(E)-2-(1-methylquinolin-1-ium-4-yl)vinyl]aniline CAS Name: N,N-bis(2-chloroethyl)-4-[(E)-2-(1-methyl-4-quinolin-1-iumyl)ethenyl]aniline IUPAC Name: N,N-bis(2-chloroethyl)-4-[(E)-2-(1-methylquinolin-1-ium-4-yl)ethenyl]aniline Traditional Name: bis(2-chloroethyl)-[4-[(E)-2-(1-methylquinolin-1-ium-4-yl)vinyl]phenyl]amine Formula: C22H23Cl2N2+ MolecularWeight: 386.33742

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C2=CC=CC=C21)C=CC3=CC=C(C=C3)N(CCCl)CCCl

Isomeric SMILES

C[N+]1=CC=C(C2=CC=CC=C21)/C=C/C3=CC=C(C=C3)N(CCCl)CCCl

InChI

InChI=1S/C22H23Cl2N2/c1-25-15-12-19(21-4-2-3-5-22(21)25)9-6-18-7-10-20(11-8-18)26(16-13-23)17-14-24/h2-12,15H,13-14,16-17H2,1H3/q+1