2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-morpholin-4-yl-quinolin-1-ium-4-ol

Systemtic Name: 2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-morpholin-4-yl-quinolin-1-ium-4-ol Openeye Name: 2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-morpholino-quinolin-1-ium-4-ol CAS Name: 2-methyl-3-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-6-(4-morpholinyl)-4-quinolin-1-iumol IUPAC Name: 2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-morpholin-4-ylquinolin-1-ium-4-ol Traditional Name: 2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-morpholino-quinolin-1-ium-4-ol Formula: C20H31N4O2+3 MolecularWeight: 359.48574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=C(C=C(C=C2)N3CCOCC3)C(=C1C[NH+]4CC[NH+](CC4)C)O

Isomeric SMILES

CC1=[NH+]C2=C(C=C(C=C2)N3CCOCC3)C(=C1C[NH+]4CC[NH+](CC4)C)O

InChI

InChI=1S/C20H28N4O2/c1-15-18(14-23-7-5-22(2)6-8-23)20(25)17-13-16(3-4-19(17)21-15)24-9-11-26-12-10-24/h3-4,13H,5-12,14H2,1-2H3,(H,21,25)/p+3