copper 5-azanyl-1-(phenylmethyl)imidazole-4-carboxylate

Systemtic Name: copper 5-azanyl-1-(phenylmethyl)imidazole-4-carboxylate Openeye Name: copper 5-amino-1-benzyl-imidazole-4-carboxylate CAS Name: copper 5-amino-1-(phenylmethyl)-4-imidazolecarboxylate IUPAC Name: copper 5-amino-1-benzylimidazole-4-carboxylate Traditional Name: cupric 5-amino-1-benzyl-imidazole-4-carboxylate Formula: C22H20CuN6O4 MolecularWeight: 495.978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC(=C2N)C(=O)[O-].C1=CC=C(C=C1)CN2C=NC(=C2N)C(=O)[O-].[Cu+2]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC(=C2N)C(=O)[O-].C1=CC=C(C=C1)CN2C=NC(=C2N)C(=O)[O-].[Cu+2]

InChI

InChI=1S/2C11H11N3O2.Cu/c2*12-10-9(11(15)16)13-7-14(10)6-8-4-2-1-3-5-8;/h2*1-5,7H,6,12H2,(H,15,16);/q;;+2/p-2