N'-(5-bromanyl-2-oxidanylidene-indol-3-yl)-4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzohydrazide

Systemtic Name: N'-(5-bromanyl-2-oxidanylidene-indol-3-yl)-4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzohydrazide Openeye Name: N'-(5-bromo-2-oxo-indol-3-yl)-4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzohydrazide CAS Name: N'-(5-bromo-2-oxo-3-indolyl)-4-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]benzohydrazide IUPAC Name: N'-(5-bromo-2-oxoindol-3-yl)-4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzohydrazide Traditional Name: N'-(5-bromo-2-keto-indol-3-yl)-4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzohydrazide Formula: C27H27BrN5O3+ MolecularWeight: 549.43898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)C(=O)NNC4=C5C=C(C=CC5=NC4=O)Br

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)C(=O)NNC4=C5C=C(C=CC5=NC4=O)Br

InChI

InChI=1S/C27H26BrN5O3/c1-36-24-5-3-2-4-23(24)33-14-12-32(13-15-33)17-18-6-8-19(9-7-18)26(34)31-30-25-21-16-20(28)10-11-22(21)29-27(25)35/h2-11,16H,12-15,17H2,1H3,(H,31,34)(H,29,30,35)/p+1