N-[5-[4-(diphenylmethyl)piperazin-4-ium-1-yl]sulfonyl-2-methoxy-phenyl]ethanamide

Systemtic Name: N-[5-[4-(diphenylmethyl)piperazin-4-ium-1-yl]sulfonyl-2-methoxy-phenyl]ethanamide Openeye Name: N-[5-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonyl-2-methoxy-phenyl]acetamide CAS Name: N-[5-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]sulfonyl]-2-methoxyphenyl]acetamide IUPAC Name: N-[5-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonyl-2-methoxyphenyl]acetamide Traditional Name: N-[5-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonyl-2-methoxy-phenyl]acetamide Formula: C26H30N3O4S+ MolecularWeight: 480.5991

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H29N3O4S/c1-20(30)27-24-19-23(13-14-25(24)33-2)34(31,32)29-17-15-28(16-18-29)26(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-14,19,26H,15-18H2,1-2H3,(H,27,30)/p+1