methyl (2S)-2-azanyl-5-[phenylmethoxycarbonyl-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]amino]pentanoate

Systemtic Name: methyl (2S)-2-azanyl-5-[phenylmethoxycarbonyl-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]amino]pentanoate Openeye Name: methyl (2S)-2-amino-5-[benzyloxycarbonyl-[(E)-N'-benzyloxycarbonylcarbamimidoyl]amino]pentanoate CAS Name: (2S)-2-amino-5-[[(E)-amino(phenylmethoxycarbonylimino)methyl]-phenylmethoxycarbonylamino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-2-amino-5-[phenylmethoxycarbonyl-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]amino]pentanoate Traditional Name: (2S)-2-amino-5-[carbobenzoxy-[(E)-N'-carbobenzoxyamidino]amino]valeric acid methyl ester Formula: C23H28N4O6 MolecularWeight: 456.49162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCN(C(=NC(=O)OCC1=CC=CC=C1)N)C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

COC(=O)[C@H](CCCN(/C(=N/C(=O)OCC1=CC=CC=C1)/N)C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C23H28N4O6/c1-31-20(28)19(24)13-8-14-27(23(30)33-16-18-11-6-3-7-12-18)21(25)26-22(29)32-15-17-9-4-2-5-10-17/h2-7,9-12,19H,8,13-16,24H2,1H3,(H2,25,26,29)/t19-/m0/s1