[(3R)-1-(2-methoxy-4-nitro-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl] morpholine-4-carbodithioate

Systemtic Name: [(3R)-1-(2-methoxy-4-nitro-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl] morpholine-4-carbodithioate Openeye Name: [(3R)-1-(2-methoxy-4-nitro-phenyl)-2,5-dioxo-pyrrolidin-3-yl] morpholine-4-carbodithioate CAS Name: 4-morpholinecarbodithioic acid [(3R)-1-(2-methoxy-4-nitrophenyl)-2,5-dioxo-3-pyrrolidinyl] ester IUPAC Name: [(3R)-1-(2-methoxy-4-nitrophenyl)-2,5-dioxopyrrolidin-3-yl] morpholine-4-carbodithioate Traditional Name: morpholine-4-carbodithioic acid [(3R)-2,5-diketo-1-(2-methoxy-4-nitro-phenyl)pyrrolidin-3-yl] ester Formula: C16H17N3O6S2 MolecularWeight: 411.45268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)CC(C2=O)SC(=S)N3CCOCC3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)C[C@H](C2=O)SC(=S)N3CCOCC3

InChI

InChI=1S/C16H17N3O6S2/c1-24-12-8-10(19(22)23)2-3-11(12)18-14(20)9-13(15(18)21)27-16(26)17-4-6-25-7-5-17/h2-3,8,13H,4-7,9H2,1H3/t13-/m1/s1