(2S)-2-[[3-(1H-imidazol-5-ylmethyl)phenyl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[[3-(1H-imidazol-5-ylmethyl)phenyl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[3-(1H-imidazol-5-ylmethyl)benzoyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[[3-(1H-imidazol-5-ylmethyl)phenyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[3-(1H-imidazol-5-ylmethyl)benzoyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[3-(1H-imidazol-5-ylmethyl)benzoyl]amino]-3-phenyl-propionic acid Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=CC(=CC=C2)CC3=CN=CN3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)C2=CC(=CC=C2)CC3=CN=CN3

InChI

InChI=1S/C20H19N3O3/c24-19(23-18(20(25)26)11-14-5-2-1-3-6-14)16-8-4-7-15(9-16)10-17-12-21-13-22-17/h1-9,12-13,18H,10-11H2,(H,21,22)(H,23,24)(H,25,26)/t18-/m0/s1