ethyl 2-[(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]furan-3-carboxylate

Systemtic Name: ethyl 2-[(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]furan-3-carboxylate Openeye Name: ethyl 2-[(2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoyl)oxymethyl]furan-3-carboxylate CAS Name: 2-[[[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethoxy]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloro-5-pyrrolidin-1-ylsulfonylbenzoyl)oxymethyl]furan-3-carboxylate Traditional Name: 2-[(2-chloro-5-pyrrolidinosulfonyl-benzoyl)oxymethyl]furan-3-carboxylic acid ethyl ester Formula: C19H20ClNO7S MolecularWeight: 441.8826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C19H20ClNO7S/c1-2-26-18(22)14-7-10-27-17(14)12-28-19(23)15-11-13(5-6-16(15)20)29(24,25)21-8-3-4-9-21/h5-7,10-11H,2-4,8-9,12H2,1H3