(E)-3-(7-methoxy-1-benzofuran-2-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]prop-2-enamide

Systemtic Name: (E)-3-(7-methoxy-1-benzofuran-2-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]prop-2-enamide Openeye Name: (E)-3-(7-methoxybenzofuran-2-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]prop-2-enamide CAS Name: (E)-3-(7-methoxy-2-benzofuranyl)-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-2-propenamide IUPAC Name: (E)-3-(7-methoxy-1-benzofuran-2-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]prop-2-enamide Traditional Name: (E)-3-(7-methoxybenzofuran-2-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]acrylamide Formula: C23H26N3O5S+ MolecularWeight: 456.53464

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C=CC3=CC4=C(O3)C(=CC=C4)OC

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC4=C(O3)C(=CC=C4)OC

InChI

InChI=1S/C23H25N3O5S/c1-25-12-14-26(15-13-25)32(28,29)20-9-6-18(7-10-20)24-22(27)11-8-19-16-17-4-3-5-21(30-2)23(17)31-19/h3-11,16H,12-15H2,1-2H3,(H,24,27)/p+1/b11-8+