[1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-methylsulfonylbenzoate

Systemtic Name: [1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-methylsulfonylbenzoate Openeye Name: [2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-(2-furfurylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H17NO6S MolecularWeight: 351.37428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NCC1=CC=CO1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C16H17NO6S/c1-11(15(18)17-10-13-6-4-8-22-13)23-16(19)12-5-3-7-14(9-12)24(2,20)21/h3-9,11H,10H2,1-2H3,(H,17,18)