2-[3-[(2-azanyl-3-phenyl-propanoyl)amino]propanoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[3-[(2-azanyl-3-phenyl-propanoyl)amino]propanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[3-[(2-amino-3-phenyl-propanoyl)amino]propanoylamino]-3-phenyl-propanoic acid CAS Name: 2-[[3-[(2-amino-1-oxo-3-phenylpropyl)amino]-1-oxopropyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[3-[(2-amino-3-phenylpropanoyl)amino]propanoylamino]-3-phenylpropanoic acid Traditional Name: 3-phenyl-2-[3-(phenylalanylamino)propanoylamino]propionic acid Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCC(=O)NC(CC2=CC=CC=C2)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NCCC(=O)NC(CC2=CC=CC=C2)C(=O)O)N

InChI

InChI=1S/C21H25N3O4/c22-17(13-15-7-3-1-4-8-15)20(26)23-12-11-19(25)24-18(21(27)28)14-16-9-5-2-6-10-16/h1-10,17-18H,11-14,22H2,(H,23,26)(H,24,25)(H,27,28)