furan-2-ylmethyl-[2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: furan-2-ylmethyl-[2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 2-furylmethyl-[2-[4-methoxy-3-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 2-furanylmethyl-[2-[4-methoxy-3-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-methylammonium IUPAC Name: furan-2-ylmethyl-[2-(4-methoxy-3-piperidin-1-ylsulfonylanilino)-2-oxoethyl]-methylazanium Traditional Name: 2-furfuryl-[2-keto-2-(4-methoxy-3-piperidinosulfonyl-anilino)ethyl]-methyl-ammonium Formula: C20H28N3O5S+ MolecularWeight: 422.51842

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CO1)CC(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[NH+](CC1=CC=CO1)CC(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H27N3O5S/c1-22(14-17-7-6-12-28-17)15-20(24)21-16-8-9-18(27-2)19(13-16)29(25,26)23-10-4-3-5-11-23/h6-9,12-13H,3-5,10-11,14-15H2,1-2H3,(H,21,24)/p+1