2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 4-phenylbutanoic acid

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 4-phenylbutanoic acid Openeye Name: 2-amino-5-guanidino-pentanoic acid; 4-phenylbutanoic acid CAS Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; 4-phenylbutanoic acid IUPAC Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; 4-phenylbutanoic acid Traditional Name: 2-amino-5-guanidino-valeric acid; 4-phenylbutyric acid Formula: C16H26N4O4 MolecularWeight: 338.40204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(=O)O.C(CC(C(=O)O)N)CN=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)CCCC(=O)O.C(CC(C(=O)O)N)CN=C(N)N

InChI

InChI=1S/C10H12O2.C6H14N4O2/c11-10(12)8-4-7-9-5-2-1-3-6-9;7-4(5(11)12)2-1-3-10-6(8)9/h1-3,5-6H,4,7-8H2,(H,11,12);4H,1-3,7H2,(H,11,12)(H4,8,9,10)