2-(2-methoxy-4-prop-2-enyl-phenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanamide

Systemtic Name: 2-(2-methoxy-4-prop-2-enyl-phenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanamide Openeye Name: 2-(4-allyl-2-methoxy-phenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide CAS Name: 2-(2-methoxy-4-prop-2-enylphenoxy)-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]acetamide IUPAC Name: 2-(2-methoxy-4-prop-2-enylphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide Traditional Name: 2-(4-allyl-2-methoxy-phenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide Formula: C23H30N3O5S+ MolecularWeight: 460.5664

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=C(C=C(C=C3)CC=C)OC

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=C(C=C(C=C3)CC=C)OC

InChI

InChI=1S/C23H29N3O5S/c1-4-5-18-6-11-21(22(16-18)30-3)31-17-23(27)24-19-7-9-20(10-8-19)32(28,29)26-14-12-25(2)13-15-26/h4,6-11,16H,1,5,12-15,17H2,2-3H3,(H,24,27)/p+1