[4-[3-(4-methylpiperazine-1,4-diium-1-yl)propoxy]phenyl]-phenyl-methanone

Systemtic Name: [4-[3-(4-methylpiperazine-1,4-diium-1-yl)propoxy]phenyl]-phenyl-methanone Openeye Name: [4-[3-(4-methylpiperazine-1,4-diium-1-yl)propoxy]phenyl]-phenyl-methanone CAS Name: [4-[3-(4-methyl-1-piperazine-1,4-diiumyl)propoxy]phenyl]-phenylmethanone IUPAC Name: [4-[3-(4-methylpiperazine-1,4-diium-1-yl)propoxy]phenyl]-phenylmethanone Traditional Name: [4-[3-(4-methylpiperazine-1,4-diium-1-yl)propoxy]phenyl]-phenyl-methanone Formula: C21H28N2O2+2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCOC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCOC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2/c1-22-13-15-23(16-14-22)12-5-17-25-20-10-8-19(9-11-20)21(24)18-6-3-2-4-7-18/h2-4,6-11H,5,12-17H2,1H3/p+2