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

Systemtic Name: [5-oxidanylidene-1-[(4-phenoxyphenyl)methyl]-2-(phenylmethyl)pyrrolidin-3-yl] methanesulfonate Openeye Name: [2-benzyl-5-oxo-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl] methanesulfonate CAS Name: methanesulfonic acid [5-oxo-1-[(4-phenoxyphenyl)methyl]-2-(phenylmethyl)-3-pyrrolidinyl] ester IUPAC Name: [2-benzyl-5-oxo-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-benzyl-5-keto-1-(4-phenoxybenzyl)pyrrolidin-3-yl] ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CC(=O)N(C1CC2=CC=CC=C2)CC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)OC1CC(=O)N(C1CC2=CC=CC=C2)CC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H25NO5S/c1-32(28,29)31-24-17-25(27)26(23(24)16-19-8-4-2-5-9-19)18-20-12-14-22(15-13-20)30-21-10-6-3-7-11-21/h2-15,23-24H,16-18H2,1H3