2-[(2-azanyl-3-phenyl-propanoyl)amino]-5-[bis(azanyl)methylideneamino]pentanoic acid

Systemtic Name: 2-[(2-azanyl-3-phenyl-propanoyl)amino]-5-[bis(azanyl)methylideneamino]pentanoic acid Openeye Name: 2-[(2-amino-3-phenyl-propanoyl)amino]-5-guanidino-pentanoic acid CAS Name: 2-[(2-amino-1-oxo-3-phenylpropyl)amino]-5-(diaminomethylideneamino)pentanoic acid IUPAC Name: 2-[(2-amino-3-phenylpropanoyl)amino]-5-(diaminomethylideneamino)pentanoic acid Traditional Name: 5-guanidino-2-(phenylalanylamino)valeric acid Formula: C15H23N5O3 MolecularWeight: 321.37482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CCCN=C(N)N)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC(CCCN=C(N)N)C(=O)O)N

InChI

InChI=1S/C15H23N5O3/c16-11(9-10-5-2-1-3-6-10)13(21)20-12(14(22)23)7-4-8-19-15(17)18/h1-3,5-6,11-12H,4,7-9,16H2,(H,20,21)(H,22,23)(H4,17,18,19)