(4-nitrophenyl)methyl N-[4-oxidanylidene-3-[(triphenylmethyl)sulfanylmethyl]azetidin-2-yl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[4-oxidanylidene-3-[(triphenylmethyl)sulfanylmethyl]azetidin-2-yl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[4-oxo-3-(tritylsulfanylmethyl)azetidin-2-yl]carbamate CAS Name: N-[4-oxo-3-[[(triphenylmethyl)thio]methyl]-2-azetidinyl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[4-oxo-3-(tritylsulfanylmethyl)azetidin-2-yl]carbamate Traditional Name: N-[4-keto-3-[(tritylthio)methyl]azetidin-2-yl]carbamic acid (4-nitrobenzyl) ester Formula: C31H27N3O5S MolecularWeight: 553.62818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCC4C(NC4=O)NC(=O)OCC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCC4C(NC4=O)NC(=O)OCC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H27N3O5S/c35-29-27(28(32-29)33-30(36)39-20-22-16-18-26(19-17-22)34(37)38)21-40-31(23-10-4-1-5-11-23,24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-19,27-28H,20-21H2,(H,32,35)(H,33,36)