(2E,4E)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]hexa-2,4-dienamide

Systemtic Name: (2E,4E)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]hexa-2,4-dienamide Openeye Name: (2E,4E)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]hexa-2,4-dienamide CAS Name: (2E,4E)-N-[2-methoxy-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]hexa-2,4-dienamide IUPAC Name: (2E,4E)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]hexa-2,4-dienamide Traditional Name: (2E,4E)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]hexa-2,4-dienamide Formula: C18H26N3O4S+ MolecularWeight: 380.48174

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CC[NH+](CC2)C)OC

Isomeric SMILES

C/C=C/C=C/C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CC[NH+](CC2)C)OC

InChI

InChI=1S/C18H25N3O4S/c1-4-5-6-7-18(22)19-16-14-15(8-9-17(16)25-3)26(23,24)21-12-10-20(2)11-13-21/h4-9,14H,10-13H2,1-3H3,(H,19,22)/p+1/b5-4+,7-6+