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

Systemtic Name: N,N-bis(2-chloroethyl)-4-[(4-methylquinolin-1-ium-1-yl)methyl]aniline Openeye Name: N,N-bis(2-chloroethyl)-4-[(4-methylquinolin-1-ium-1-yl)methyl]aniline CAS Name: N,N-bis(2-chloroethyl)-4-[(4-methyl-1-quinolin-1-iumyl)methyl]aniline IUPAC Name: N,N-bis(2-chloroethyl)-4-[(4-methylquinolin-1-ium-1-yl)methyl]aniline Traditional Name: bis(2-chloroethyl)-[4-[(4-methylquinolin-1-ium-1-yl)methyl]phenyl]amine Formula: C21H23Cl2N2+ MolecularWeight: 374.32672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C2=CC=CC=C12)CC3=CC=C(C=C3)N(CCCl)CCCl

Isomeric SMILES

CC1=CC=[N+](C2=CC=CC=C12)CC3=CC=C(C=C3)N(CCCl)CCCl

InChI

InChI=1S/C21H23Cl2N2/c1-17-10-13-25(21-5-3-2-4-20(17)21)16-18-6-8-19(9-7-18)24(14-11-22)15-12-23/h2-10,13H,11-12,14-16H2,1H3/q+1