N-(5-acetamido-2-methoxy-phenyl)-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]acetamide Formula: C23H29N4O4+ MolecularWeight: 425.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)NC(=O)C)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)NC(=O)C)OC

InChI

InChI=1S/C23H28N4O4/c1-16(28)18-4-7-20(8-5-18)27-12-10-26(11-13-27)15-23(30)25-21-14-19(24-17(2)29)6-9-22(21)31-3/h4-9,14H,10-13,15H2,1-3H3,(H,24,29)(H,25,30)/p+1