N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(2-methoxyphenyl)ethanamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(2-methoxyphenyl)ethanamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(2-methoxyphenyl)acetamide CAS Name: N-[4-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-2-(2-methoxyphenyl)acetamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(2-methoxyphenyl)acetamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(2-methoxyphenyl)acetamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=CC=CC=C3OC

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=CC=CC=C3OC

InChI

InChI=1S/C21H27N3O4S/c1-3-23-12-14-24(15-13-23)29(26,27)19-10-8-18(9-11-19)22-21(25)16-17-6-4-5-7-20(17)28-2/h4-11H,3,12-16H2,1-2H3,(H,22,25)/p+1