2-[[(2R)-6-azanyl-2-[(2-azanyl-3-phenyl-propanoyl)amino]hexanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[(2R)-6-azanyl-2-[(2-azanyl-3-phenyl-propanoyl)amino]hexanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[(2R)-6-amino-2-[(2-amino-3-phenyl-propanoyl)amino]hexanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(2R)-6-amino-2-[(2-amino-1-oxo-3-phenylpropyl)amino]-1-oxohexyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[(2R)-6-amino-2-[(2-amino-3-phenylpropanoyl)amino]hexanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[(2R)-6-amino-2-(phenylalanylamino)hexanoyl]amino]-3-phenyl-propionic acid Formula: C24H32N4O4 MolecularWeight: 440.53528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)N[C@H](CCCCN)C(=O)NC(CC2=CC=CC=C2)C(=O)O)N

InChI

InChI=1S/C24H32N4O4/c25-14-8-7-13-20(27-22(29)19(26)15-17-9-3-1-4-10-17)23(30)28-21(24(31)32)16-18-11-5-2-6-12-18/h1-6,9-12,19-21H,7-8,13-16,25-26H2,(H,27,29)(H,28,30)(H,31,32)/t19?,20-,21?/m1/s1