2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N'-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]ethanehydrazide

Systemtic Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N'-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]ethanehydrazide Openeye Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N'-[(5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazin-1-iumyl]-N'-[(5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]acetohydrazide IUPAC Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N'-[(5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide Traditional Name: 2-(4-brosylpiperazin-1-ium-1-yl)-N'-[(6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide Formula: C20H24BrN4O5S+ MolecularWeight: 512.39736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=CNNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)C1=O

Isomeric SMILES

COC1=CC=CC(=CNNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)C1=O

InChI

InChI=1S/C20H23BrN4O5S/c1-30-18-4-2-3-15(20(18)27)13-22-23-19(26)14-24-9-11-25(12-10-24)31(28,29)17-7-5-16(21)6-8-17/h2-8,13,22H,9-12,14H2,1H3,(H,23,26)/p+1