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

Systemtic Name: 2-[(2-azanyl-3-phenyl-propanoyl)-propyl-amino]-5-[bis(azanyl)methylideneamino]pentanoic acid Openeye Name: 2-[(2-amino-3-phenyl-propanoyl)-propyl-amino]-5-guanidino-pentanoic acid CAS Name: 2-[(2-amino-1-oxo-3-phenylpropyl)-propylamino]-5-(diaminomethylideneamino)pentanoic acid IUPAC Name: 2-[(2-amino-3-phenylpropanoyl)-propylamino]-5-(diaminomethylideneamino)pentanoic acid Traditional Name: 5-guanidino-2-[phenylalanyl(propyl)amino]valeric acid Formula: C18H29N5O3 MolecularWeight: 363.45456

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(CCCN=C(N)N)C(=O)O)C(=O)C(CC1=CC=CC=C1)N

Isomeric SMILES

CCCN(C(CCCN=C(N)N)C(=O)O)C(=O)C(CC1=CC=CC=C1)N

InChI

InChI=1S/C18H29N5O3/c1-2-11-23(15(17(25)26)9-6-10-22-18(20)21)16(24)14(19)12-13-7-4-3-5-8-13/h3-5,7-8,14-15H,2,6,9-12,19H2,1H3,(H,25,26)(H4,20,21,22)