2-[4-(3-imidazol-1-ylpropanoylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(3-imidazol-1-ylpropanoylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(3-imidazol-1-ylpropanoylamino)phenyl]acetic acid CAS Name: 2-[4-[[3-(1-imidazolyl)-1-oxopropyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-(3-imidazol-1-ylpropanoylamino)phenyl]acetic acid Traditional Name: 2-[4-(3-imidazol-1-ylpropanoylamino)phenyl]acetic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)NC(=O)CCN2C=CN=C2

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)NC(=O)CCN2C=CN=C2

InChI

InChI=1S/C14H15N3O3/c18-13(5-7-17-8-6-15-10-17)16-12-3-1-11(2-4-12)9-14(19)20/h1-4,6,8,10H,5,7,9H2,(H,16,18)(H,19,20)