8-methoxy-2-methyl-4-piperazin-4-ium-1-yl-quinolin-1-ium

Systemtic Name: 8-methoxy-2-methyl-4-piperazin-4-ium-1-yl-quinolin-1-ium Openeye Name: 8-methoxy-2-methyl-4-piperazin-4-ium-1-yl-quinolin-1-ium CAS Name: 8-methoxy-2-methyl-4-(1-piperazin-4-iumyl)quinolin-1-ium IUPAC Name: 8-methoxy-2-methyl-4-piperazin-4-ium-1-ylquinolin-1-ium Traditional Name: 8-methoxy-2-methyl-4-piperazin-4-ium-1-yl-quinolin-1-ium Formula: C15H21N3O+2 MolecularWeight: 259.34674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=C(C=CC=C2OC)C(=C1)N3CC[NH2+]CC3

Isomeric SMILES

CC1=[NH+]C2=C(C=CC=C2OC)C(=C1)N3CC[NH2+]CC3

InChI

InChI=1S/C15H19N3O/c1-11-10-13(18-8-6-16-7-9-18)12-4-3-5-14(19-2)15(12)17-11/h3-5,10,16H,6-9H2,1-2H3/p+2