N-methyl-2-[[2-[(1-methylpiperazin-1-ium-1-yl)methyl]phenyl]-oxidanyl-phenyl-methyl]benzamide

Systemtic Name: N-methyl-2-[[2-[(1-methylpiperazin-1-ium-1-yl)methyl]phenyl]-oxidanyl-phenyl-methyl]benzamide Openeye Name: 2-[hydroxy-[2-[(1-methylpiperazin-1-ium-1-yl)methyl]phenyl]-phenyl-methyl]-N-methyl-benzamide CAS Name: 2-[hydroxy-[2-[(1-methyl-1-piperazin-1-iumyl)methyl]phenyl]-phenylmethyl]-N-methylbenzamide IUPAC Name: 2-[hydroxy-[2-[(1-methylpiperazin-1-ium-1-yl)methyl]phenyl]-phenylmethyl]-N-methylbenzamide Traditional Name: 2-[hydroxy-[2-[(1-methylpiperazin-1-ium-1-yl)methyl]phenyl]-phenyl-methyl]-N-methyl-benzamide Formula: C27H32N3O2+ MolecularWeight: 430.56188

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC=C1C(C2=CC=CC=C2)(C3=CC=CC=C3C[N+]4(CCNCC4)C)O

Isomeric SMILES

CNC(=O)C1=CC=CC=C1C(C2=CC=CC=C2)(C3=CC=CC=C3C[N+]4(CCNCC4)C)O

InChI

InChI=1S/C27H31N3O2/c1-28-26(31)23-13-7-9-15-25(23)27(32,22-11-4-3-5-12-22)24-14-8-6-10-21(24)20-30(2)18-16-29-17-19-30/h3-15,29,32H,16-20H2,1-2H3/p+1