[(3S)-1-[5-(methoxymethoxy)-6-(phenylmethyl)pyridin-2-yl]-2-oxidanylidene-pyrrolidin-3-yl] 3-nitrobenzenesulfonate

Systemtic Name: [(3S)-1-[5-(methoxymethoxy)-6-(phenylmethyl)pyridin-2-yl]-2-oxidanylidene-pyrrolidin-3-yl] 3-nitrobenzenesulfonate Openeye Name: [(3S)-1-[6-benzyl-5-(methoxymethoxy)-2-pyridyl]-2-oxo-pyrrolidin-3-yl] 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid [(3S)-1-[5-(methoxymethoxy)-6-(phenylmethyl)-2-pyridinyl]-2-oxo-3-pyrrolidinyl] ester IUPAC Name: [(3S)-1-[6-benzyl-5-(methoxymethoxy)pyridin-2-yl]-2-oxopyrrolidin-3-yl] 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid [(3S)-1-[6-benzyl-5-(methoxymethoxy)-2-pyridyl]-2-keto-pyrrolidin-3-yl] ester Formula: C24H23N3O8S MolecularWeight: 513.51972

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=C(N=C(C=C1)N2CCC(C2=O)OS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

COCOC1=C(N=C(C=C1)N2CC[C@@H](C2=O)OS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C24H23N3O8S/c1-33-16-34-21-10-11-23(25-20(21)14-17-6-3-2-4-7-17)26-13-12-22(24(26)28)35-36(31,32)19-9-5-8-18(15-19)27(29)30/h2-11,15,22H,12-14,16H2,1H3/t22-/m0/s1