2-[2-[4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)imidazol-1-yl]ethanoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-[4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)imidazol-1-yl]ethanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-[4-(2-amino-3-hydroxy-3-oxo-propyl)imidazol-1-yl]acetyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[4-(2-amino-3-hydroxy-3-oxopropyl)-1-imidazolyl]-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-[4-(2-amino-3-hydroxy-3-oxopropyl)imidazol-1-yl]acetyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[4-(2-amino-3-hydroxy-3-keto-propyl)imidazol-1-yl]acetyl]amino]-3-phenyl-propionic acid Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)CN2C=C(N=C2)CC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)CN2C=C(N=C2)CC(C(=O)O)N

InChI

InChI=1S/C17H20N4O5/c18-13(16(23)24)7-12-8-21(10-19-12)9-15(22)20-14(17(25)26)6-11-4-2-1-3-5-11/h1-5,8,10,13-14H,6-7,9,18H2,(H,20,22)(H,23,24)(H,25,26)