[(E)-(5-oxidanylidene-1-phenylmethoxy-pyrrolidin-2-ylidene)methyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-(5-oxidanylidene-1-phenylmethoxy-pyrrolidin-2-ylidene)methyl] 4-methylbenzenesulfonate Openeye Name: [(E)-(1-benzyloxy-5-oxo-pyrrolidin-2-ylidene)methyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-(5-oxo-1-phenylmethoxy-2-pyrrolidinylidene)methyl] ester IUPAC Name: [(E)-(5-oxo-1-phenylmethoxypyrrolidin-2-ylidene)methyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-(1-benzoxy-5-keto-pyrrolidin-2-ylidene)methyl] ester Formula: C19H19NO5S MolecularWeight: 373.42286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC=C2CCC(=O)N2OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O/C=C/2\CCC(=O)N2OCC3=CC=CC=C3

InChI

InChI=1S/C19H19NO5S/c1-15-7-10-18(11-8-15)26(22,23)25-14-17-9-12-19(21)20(17)24-13-16-5-3-2-4-6-16/h2-8,10-11,14H,9,12-13H2,1H3/b17-14+