[2-(4-ethanoylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl-[(2-methoxyquinolin-3-yl)methyl]azanium

Systemtic Name: [2-(4-ethanoylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl-[(2-methoxyquinolin-3-yl)methyl]azanium Openeye Name: [2-(4-acetylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl-[(2-methoxy-3-quinolyl)methyl]ammonium CAS Name: [2-(4-acetyl-1-piperazinyl)-3-pyridin-1-iumyl]methyl-[(2-methoxy-3-quinolinyl)methyl]ammonium IUPAC Name: [2-(4-acetylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl-[(2-methoxyquinolin-3-yl)methyl]azanium Traditional Name: [2-(4-acetylpiperazino)pyridin-1-ium-3-yl]methyl-[(2-methoxy-3-quinolyl)methyl]ammonium Formula: C23H29N5O2+2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=CC=[NH+]2)C[NH2+]CC3=CC4=CC=CC=C4N=C3OC

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=CC=[NH+]2)C[NH2+]CC3=CC4=CC=CC=C4N=C3OC

InChI

InChI=1S/C23H27N5O2/c1-17(29)27-10-12-28(13-11-27)22-19(7-5-9-25-22)15-24-16-20-14-18-6-3-4-8-21(18)26-23(20)30-2/h3-9,14,24H,10-13,15-16H2,1-2H3/p+2