[2-methyl-5-oxidanylidene-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl] methanesulfonate

Systemtic Name: [2-methyl-5-oxidanylidene-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl] methanesulfonate Openeye Name: [2-methyl-5-oxo-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl] methanesulfonate CAS Name: methanesulfonic acid [2-methyl-5-oxo-1-[(4-phenoxyphenyl)methyl]-3-pyrrolidinyl] ester IUPAC Name: [2-methyl-5-oxo-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [5-keto-2-methyl-1-(4-phenoxybenzyl)pyrrolidin-3-yl] ester Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(=O)N1CC2=CC=C(C=C2)OC3=CC=CC=C3)OS(=O)(=O)C

Isomeric SMILES

CC1C(CC(=O)N1CC2=CC=C(C=C2)OC3=CC=CC=C3)OS(=O)(=O)C

InChI

InChI=1S/C19H21NO5S/c1-14-18(25-26(2,22)23)12-19(21)20(14)13-15-8-10-17(11-9-15)24-16-6-4-3-5-7-16/h3-11,14,18H,12-13H2,1-2H3