(phenylmethyl) N-(7-oxidanylheptyl)-N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]carbamate

Systemtic Name: (phenylmethyl) N-(7-oxidanylheptyl)-N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]carbamate Openeye Name: benzyl N-[(E)-N'-benzyloxycarbonylcarbamimidoyl]-N-(7-hydroxyheptyl)carbamate CAS Name: N-[(E)-amino(phenylmethoxycarbonylimino)methyl]-N-(7-hydroxyheptyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(7-hydroxyheptyl)-N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]carbamate Traditional Name: N-[(E)-N'-carbobenzoxyamidino]-N-(7-hydroxyheptyl)carbamic acid benzyl ester Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N=C(N)N(CCCCCCCO)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O5/c25-22(26-23(29)31-18-20-12-6-4-7-13-20)27(16-10-2-1-3-11-17-28)24(30)32-19-21-14-8-5-9-15-21/h4-9,12-15,28H,1-3,10-11,16-19H2,(H2,25,26,29)