3-methyl-N-[3-oxidanylidene-3-[2-(4-phenylpiperazin-1-ium-1-yl)ethylamino]propyl]benzamide

Systemtic Name: 3-methyl-N-[3-oxidanylidene-3-[2-(4-phenylpiperazin-1-ium-1-yl)ethylamino]propyl]benzamide Openeye Name: 3-methyl-N-[3-oxo-3-[2-(4-phenylpiperazin-1-ium-1-yl)ethylamino]propyl]benzamide CAS Name: 3-methyl-N-[3-oxo-3-[2-(4-phenyl-1-piperazin-1-iumyl)ethylamino]propyl]benzamide IUPAC Name: 3-methyl-N-[3-oxo-3-[2-(4-phenylpiperazin-1-ium-1-yl)ethylamino]propyl]benzamide Traditional Name: N-[3-keto-3-[2-(4-phenylpiperazin-1-ium-1-yl)ethylamino]propyl]-3-methyl-benzamide Formula: C23H31N4O2+ MolecularWeight: 395.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCC(=O)NCC[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCC(=O)NCC[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C23H30N4O2/c1-19-6-5-7-20(18-19)23(29)25-11-10-22(28)24-12-13-26-14-16-27(17-15-26)21-8-3-2-4-9-21/h2-9,18H,10-17H2,1H3,(H,24,28)(H,25,29)/p+1