methyl 3-methyl-5-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 3-methyl-5-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]furan-2-carboxylate Openeye Name: methyl 3-methyl-5-[[4-methyl-3-(1-piperidylsulfonyl)benzoyl]oxymethyl]furan-2-carboxylate CAS Name: 3-methyl-5-[[[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-oxomethoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-5-[(4-methyl-3-piperidin-1-ylsulfonylbenzoyl)oxymethyl]furan-2-carboxylate Traditional Name: 3-methyl-5-[(4-methyl-3-piperidinosulfonyl-benzoyl)oxymethyl]furan-2-carboxylic acid methyl ester Formula: C21H25NO7S MolecularWeight: 435.4907

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC(=C(O2)C(=O)OC)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC(=C(O2)C(=O)OC)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H25NO7S/c1-14-7-8-16(12-18(14)30(25,26)22-9-5-4-6-10-22)20(23)28-13-17-11-15(2)19(29-17)21(24)27-3/h7-8,11-12H,4-6,9-10,13H2,1-3H3