N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-(4-methoxyphenyl)propanamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-(4-methoxyphenyl)propanamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-(4-methoxyphenyl)propanamide CAS Name: N-[4-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-3-(4-methoxyphenyl)propanamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-(4-methoxyphenyl)propanamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-(4-methoxyphenyl)propionamide Formula: C22H30N3O4S+ MolecularWeight: 432.5563

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H29N3O4S/c1-3-24-14-16-25(17-15-24)30(27,28)21-11-7-19(8-12-21)23-22(26)13-6-18-4-9-20(29-2)10-5-18/h4-5,7-12H,3,6,13-17H2,1-2H3,(H,23,26)/p+1