N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanoylamino]benzamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanoylamino]benzamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[2-[4-(2-pyridyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[1-oxo-2-[4-(2-pyridinyl)-1-piperazin-1-iumyl]ethyl]amino]benzamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)acetyl]amino]benzamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[2-[4-(2-pyridyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C26H29ClN5O3+ MolecularWeight: 494.99316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C26H28ClN5O3/c1-18-15-22(23(35-2)16-20(18)27)30-26(34)19-7-3-4-8-21(19)29-25(33)17-31-11-13-32(14-12-31)24-9-5-6-10-28-24/h3-10,15-16H,11-14,17H2,1-2H3,(H,29,33)(H,30,34)/p+1