4-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[4-(4-methoxyphenyl)sulfonyl-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C20H25N4O5S+ MolecularWeight: 433.5013

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C20H24N4O5S/c1-29-17-6-8-18(9-7-17)30(27,28)24-12-10-23(11-13-24)14-19(25)22-16-4-2-15(3-5-16)20(21)26/h2-9H,10-14H2,1H3,(H2,21,26)(H,22,25)/p+1