(4-nitrophenyl) 5-[bis(azanyl)methylideneamino]-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (4-nitrophenyl) 5-[bis(azanyl)methylideneamino]-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (4-nitrophenyl) 2-(benzyloxycarbonylamino)-5-guanidino-pentanoate CAS Name: 5-(diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 5-(diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 2-(benzyloxycarbonylamino)-5-guanidino-valeric acid (4-nitrophenyl) ester Formula: C20H23N5O6 MolecularWeight: 429.42652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCN=C(N)N)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCN=C(N)N)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O6/c21-19(22)23-12-4-7-17(24-20(27)30-13-14-5-2-1-3-6-14)18(26)31-16-10-8-15(9-11-16)25(28)29/h1-3,5-6,8-11,17H,4,7,12-13H2,(H,24,27)(H4,21,22,23)