(phenylmethyl) N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate

Systemtic Name: (phenylmethyl) N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate Openeye Name: benzyl N-[N-benzyloxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate CAS Name: N-[phenylmethoxycarbonylamino(trifluoromethylsulfonylimino)methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate Traditional Name: N-(N-carbobenzoxy-N'-triflyl-amidino)carbamic acid benzyl ester Formula: C18H16F3N3O6S MolecularWeight: 459.39635

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(=NS(=O)(=O)C(F)(F)F)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(=NS(=O)(=O)C(F)(F)F)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H16F3N3O6S/c19-18(20,21)31(27,28)24-15(22-16(25)29-11-13-7-3-1-4-8-13)23-17(26)30-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,22,23,24,25,26)