N-butyl-7-chloranyl-4-methyl-N-(phenylmethyl)quinolin-1-ium-2-amine

Systemtic Name: N-butyl-7-chloranyl-4-methyl-N-(phenylmethyl)quinolin-1-ium-2-amine Openeye Name: N-benzyl-N-butyl-7-chloro-4-methyl-quinolin-1-ium-2-amine CAS Name: N-butyl-7-chloro-4-methyl-N-(phenylmethyl)-2-quinolin-1-iumamine IUPAC Name: N-benzyl-N-butyl-7-chloro-4-methylquinolin-1-ium-2-amine Traditional Name: benzyl-butyl-(7-chloro-4-methyl-quinolin-1-ium-2-yl)amine Formula: C21H24ClN2+ MolecularWeight: 339.88166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)C2=[NH+]C3=C(C=CC(=C3)Cl)C(=C2)C

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)C2=[NH+]C3=C(C=CC(=C3)Cl)C(=C2)C

InChI

InChI=1S/C21H23ClN2/c1-3-4-12-24(15-17-8-6-5-7-9-17)21-13-16(2)19-11-10-18(22)14-20(19)23-21/h5-11,13-14H,3-4,12,15H2,1-2H3/p+1