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

Systemtic Name: methyl 5-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[2-chloro-5-(1-piperidylsulfonyl)benzoyl]oxymethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-oxomethoxy]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-chloro-5-piperidin-1-ylsulfonylbenzoyl)oxymethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[(2-chloro-5-piperidinosulfonyl-benzoyl)oxymethyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C20H22ClNO7S MolecularWeight: 455.90918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl)C(=O)OC

InChI

InChI=1S/C20H22ClNO7S/c1-13-16(19(23)27-2)10-14(29-13)12-28-20(24)17-11-15(6-7-18(17)21)30(25,26)22-8-4-3-5-9-22/h6-7,10-11H,3-5,8-9,12H2,1-2H3