[(3R,4R)-1-chrysen-6-yl-2-oxidanylidene-4-phenyl-azetidin-3-yl] methanesulfonate

Systemtic Name: [(3R,4R)-1-chrysen-6-yl-2-oxidanylidene-4-phenyl-azetidin-3-yl] methanesulfonate Openeye Name: [(3R,4R)-1-chrysen-6-yl-2-oxo-4-phenyl-azetidin-3-yl] methanesulfonate CAS Name: methanesulfonic acid [(3R,4R)-1-(6-chrysenyl)-2-oxo-4-phenyl-3-azetidinyl] ester IUPAC Name: [(3R,4R)-1-chrysen-6-yl-2-oxo-4-phenylazetidin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [(3R,4R)-1-chrysen-6-yl-2-keto-4-phenyl-azetidin-3-yl] ester Formula: C28H21NO4S MolecularWeight: 467.53564

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1C(N(C1=O)C2=CC3=C(C=CC4=CC=CC=C43)C5=CC=CC=C52)C6=CC=CC=C6

Isomeric SMILES

CS(=O)(=O)O[C@@H]1[C@H](N(C1=O)C2=CC3=C(C=CC4=CC=CC=C43)C5=CC=CC=C52)C6=CC=CC=C6

InChI

InChI=1S/C28H21NO4S/c1-34(31,32)33-27-26(19-10-3-2-4-11-19)29(28(27)30)25-17-24-20-12-6-5-9-18(20)15-16-22(24)21-13-7-8-14-23(21)25/h2-17,26-27H,1H3/t26-,27-/m1/s1