2-azanyl-5-[bis(azanyl)methylideneamino]-4-nitro-2-phenylmethoxycarbonyl-pentanoic acid

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]-4-nitro-2-phenylmethoxycarbonyl-pentanoic acid Openeye Name: 2-amino-2-benzyloxycarbonyl-5-guanidino-4-nitro-pentanoic acid CAS Name: 2-amino-5-(diaminomethylideneamino)-4-nitro-2-phenylmethoxycarbonylpentanoic acid IUPAC Name: 2-amino-5-(diaminomethylideneamino)-4-nitro-2-phenylmethoxycarbonylpentanoic acid Traditional Name: 2-amino-2-carbobenzoxy-5-guanidino-4-nitro-valeric acid Formula: C14H19N5O6 MolecularWeight: 353.33056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC(CN=C(N)N)[N+](=O)[O-])(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CC(CN=C(N)N)[N+](=O)[O-])(C(=O)O)N

InChI

InChI=1S/C14H19N5O6/c15-13(16)18-7-10(19(23)24)6-14(17,11(20)21)12(22)25-8-9-4-2-1-3-5-9/h1-5,10H,6-8,17H2,(H,20,21)(H4,15,16,18)