2-azanyl-3-[3-(2-azanyl-3-phenyl-propanoyl)-4-pyrrolidin-2-ylcarbonyl-phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3-(2-azanyl-3-phenyl-propanoyl)-4-pyrrolidin-2-ylcarbonyl-phenyl]propanoic acid Openeye Name: 2-amino-3-[3-(2-amino-3-phenyl-propanoyl)-4-(pyrrolidine-2-carbonyl)phenyl]propanoic acid CAS Name: 2-amino-3-[3-(2-amino-1-oxo-3-phenylpropyl)-4-[oxo(2-pyrrolidinyl)methyl]phenyl]propanoic acid IUPAC Name: 2-amino-3-[3-(2-amino-3-phenylpropanoyl)-4-(pyrrolidine-2-carbonyl)phenyl]propanoic acid Traditional Name: 2-amino-3-(3-phenylalanyl-4-prolyl-phenyl)propionic acid Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)C2=C(C=C(C=C2)CC(C(=O)O)N)C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

C1CC(NC1)C(=O)C2=C(C=C(C=C2)CC(C(=O)O)N)C(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C23H27N3O4/c24-18(12-14-5-2-1-3-6-14)21(27)17-11-15(13-19(25)23(29)30)8-9-16(17)22(28)20-7-4-10-26-20/h1-3,5-6,8-9,11,18-20,26H,4,7,10,12-13,24-25H2,(H,29,30)