3-(1H-imidazol-5-yl)-2-[(5-methyl-2-oxidanyl-phenyl)carbonylamino]propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[(5-methyl-2-oxidanyl-phenyl)carbonylamino]propanoic acid Openeye Name: 2-[(2-hydroxy-5-methyl-benzoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[(2-hydroxy-5-methylphenyl)-oxomethyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[(2-hydroxy-5-methylbenzoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[(2-hydroxy-5-methyl-benzoyl)amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)NC(CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C14H15N3O4/c1-8-2-3-12(18)10(4-8)13(19)17-11(14(20)21)5-9-6-15-7-16-9/h2-4,6-7,11,18H,5H2,1H3,(H,15,16)(H,17,19)(H,20,21)