(phenylmethyl) N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]-N-(1-phenylprop-2-enyl)carbamate

Systemtic Name: (phenylmethyl) N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]-N-(1-phenylprop-2-enyl)carbamate Openeye Name: benzyl N-[(E)-N'-benzyloxycarbonylcarbamimidoyl]-N-(1-phenylallyl)carbamate CAS Name: N-[(E)-amino(phenylmethoxycarbonylimino)methyl]-N-(1-phenylprop-2-enyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]-N-(1-phenylprop-2-enyl)carbamate Traditional Name: N-[(E)-N'-carbobenzoxyamidino]-N-(1-phenylallyl)carbamic acid benzyl ester Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C1=CC=CC=C1)N(C(=NC(=O)OCC2=CC=CC=C2)N)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C=CC(C1=CC=CC=C1)N(/C(=N/C(=O)OCC2=CC=CC=C2)/N)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H25N3O4/c1-2-23(22-16-10-5-11-17-22)29(26(31)33-19-21-14-8-4-9-15-21)24(27)28-25(30)32-18-20-12-6-3-7-13-20/h2-17,23H,1,18-19H2,(H2,27,28,30)