[3-acetamido-5-(4-methylpiperazin-4-ium-1-yl)carbonyl-phenyl]methyl-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]azanium

Systemtic Name: [3-acetamido-5-(4-methylpiperazin-4-ium-1-yl)carbonyl-phenyl]methyl-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]azanium Openeye Name: [3-acetamido-5-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methyl-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]ammonium CAS Name: [3-acetamido-5-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]methyl-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]ammonium IUPAC Name: [3-acetamido-5-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methyl-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]azanium Traditional Name: [3-acetamido-5-(4-methylpiperazin-4-ium-1-carbonyl)benzyl]-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]ammonium Formula: C26H37N5O2+2 MolecularWeight: 451.60428

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)N(CCC3)C)C(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)N(CCC3)C)C(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C26H35N5O2/c1-19(32)28-24-15-21(14-23(16-24)26(33)31-11-9-29(2)10-12-31)18-27-17-20-6-7-25-22(13-20)5-4-8-30(25)3/h6-7,13-16,27H,4-5,8-12,17-18H2,1-3H3,(H,28,32)/p+2