methyl 4-methyl-3-[3-(2-oxidanylidenepyrrolidin-1-yl)phenoxy]sulfonyl-benzoate

Systemtic Name: methyl 4-methyl-3-[3-(2-oxidanylidenepyrrolidin-1-yl)phenoxy]sulfonyl-benzoate Openeye Name: methyl 4-methyl-3-[3-(2-oxopyrrolidin-1-yl)phenoxy]sulfonyl-benzoate CAS Name: 4-methyl-3-[3-(2-oxo-1-pyrrolidinyl)phenoxy]sulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[3-(2-oxopyrrolidin-1-yl)phenoxy]sulfonylbenzoate Traditional Name: 3-[3-(2-ketopyrrolidino)phenoxy]sulfonyl-4-methyl-benzoic acid methyl ester Formula: C19H19NO6S MolecularWeight: 389.42226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)OC2=CC=CC(=C2)N3CCCC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)OC2=CC=CC(=C2)N3CCCC3=O

InChI

InChI=1S/C19H19NO6S/c1-13-8-9-14(19(22)25-2)11-17(13)27(23,24)26-16-6-3-5-15(12-16)20-10-4-7-18(20)21/h3,5-6,8-9,11-12H,4,7,10H2,1-2H3