2-methyl-6-morpholin-4-yl-3-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]-1H-quinolin-4-one

Systemtic Name: 2-methyl-6-morpholin-4-yl-3-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]-1H-quinolin-4-one Openeye Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-2-methyl-6-morpholino-1H-quinolin-4-one CAS Name: 2-methyl-6-(4-morpholinyl)-3-[[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]methyl]-1H-quinolin-4-one IUPAC Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-2-methyl-6-morpholin-4-yl-1H-quinolin-4-one Traditional Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-2-methyl-6-morpholino-4-quinolone Formula: C26H34N4O2+2 MolecularWeight: 434.57376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=CC(=C2)N3CCOCC3)C[NH+]4CC[NH+](CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)N3CCOCC3)C[NH+]4CC[NH+](CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H32N4O2/c1-20-24(19-29-11-9-28(10-12-29)18-21-5-3-2-4-6-21)26(31)23-17-22(7-8-25(23)27-20)30-13-15-32-16-14-30/h2-8,17H,9-16,18-19H2,1H3,(H,27,31)/p+2