(phenylmethyl) N-[(Z)-N'-phenylmethoxycarbonylcarbamimidoyl]-N-(trifluoromethylsulfonyl)carbamate

Systemtic Name: (phenylmethyl) N-[(Z)-N'-phenylmethoxycarbonylcarbamimidoyl]-N-(trifluoromethylsulfonyl)carbamate Openeye Name: benzyl N-[(Z)-N'-benzyloxycarbonylcarbamimidoyl]-N-(trifluoromethylsulfonyl)carbamate CAS Name: N-[(Z)-amino(phenylmethoxycarbonylimino)methyl]-N-(trifluoromethylsulfonyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(Z)-N'-phenylmethoxycarbonylcarbamimidoyl]-N-(trifluoromethylsulfonyl)carbamate Traditional Name: N-[(Z)-N'-carbobenzoxyamidino]-N-triflyl-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)N=C(N)N(C(=O)OCC2=CC=CC=C2)S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)/N=C(/N)\N(C(=O)OCC2=CC=CC=C2)S(=O)(=O)C(F)(F)F

InChI

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