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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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