2-(5-ethanoyl-2-methoxy-phenyl)-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(5-ethanoyl-2-methoxy-phenyl)-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2-(5-acetyl-2-methoxy-phenyl)-1-(4-benzylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-(5-acetyl-2-methoxyphenyl)-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(5-acetyl-2-methoxyphenyl)-1-(4-benzylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-(5-acetyl-2-methoxy-phenyl)-1-(4-benzylpiperazin-4-ium-1-yl)ethanone Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3/c1-17(25)19-8-9-21(27-2)20(14-19)15-22(26)24-12-10-23(11-13-24)16-18-6-4-3-5-7-18/h3-9,14H,10-13,15-16H2,1-2H3/p+1