(phenylmethyl) N-(4-oxidanylbutyl)-N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]carbamate

Systemtic Name: (phenylmethyl) N-(4-oxidanylbutyl)-N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]carbamate Openeye Name: benzyl N-[(E)-N'-benzyloxycarbonylcarbamimidoyl]-N-(4-hydroxybutyl)carbamate CAS Name: N-[(E)-amino(phenylmethoxycarbonylimino)methyl]-N-(4-hydroxybutyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(4-hydroxybutyl)-N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]carbamate Traditional Name: N-[(E)-N'-carbobenzoxyamidino]-N-(4-hydroxybutyl)carbamic acid benzyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O5/c22-19(23-20(26)28-15-17-9-3-1-4-10-17)24(13-7-8-14-25)21(27)29-16-18-11-5-2-6-12-18/h1-6,9-12,25H,7-8,13-16H2,(H2,22,23,26)