3-(methoxymethyl)-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(methoxymethyl)-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1-benzofuran-2-carboxamide Openeye Name: 3-(methoxymethyl)-N-[1-(p-tolylsulfonyl)-4-piperidyl]benzofuran-2-carboxamide CAS Name: 3-(methoxymethyl)-N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-2-benzofurancarboxamide IUPAC Name: 3-(methoxymethyl)-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1-benzofuran-2-carboxamide Traditional Name: 3-(methoxymethyl)-N-(1-tosyl-4-piperidyl)coumarilamide Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=C(C4=CC=CC=C4O3)COC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=C(C4=CC=CC=C4O3)COC

InChI

InChI=1S/C23H26N2O5S/c1-16-7-9-18(10-8-16)31(27,28)25-13-11-17(12-14-25)24-23(26)22-20(15-29-2)19-5-3-4-6-21(19)30-22/h3-10,17H,11-15H2,1-2H3,(H,24,26)