2-[(3,4-dichlorophenyl)carbonylamino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 2-[(3,4-dichlorophenyl)carbonylamino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-[(3,4-dichlorobenzoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[(3,4-dichlorophenyl)-oxomethyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[(3,4-dichlorobenzoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[(3,4-dichlorobenzoyl)amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C13H11Cl2N3O3 MolecularWeight: 328.15074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NC(CC2=CN=CN2)C(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NC(CC2=CN=CN2)C(=O)O)Cl)Cl

InChI

InChI=1S/C13H11Cl2N3O3/c14-9-2-1-7(3-10(9)15)12(19)18-11(13(20)21)4-8-5-16-6-17-8/h1-3,5-6,11H,4H2,(H,16,17)(H,18,19)(H,20,21)