2-[carboxy(phenethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 2-[carboxy(phenethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-[carboxy(phenethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[carboxy(phenethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[carboxy(phenethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[carboxy(phenethyl)amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(C(CC2=CN=CN2)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCN(C(CC2=CN=CN2)C(=O)O)C(=O)O

InChI

InChI=1S/C15H17N3O4/c19-14(20)13(8-12-9-16-10-17-12)18(15(21)22)7-6-11-4-2-1-3-5-11/h1-5,9-10,13H,6-8H2,(H,16,17)(H,19,20)(H,21,22)