diethyl 2-[[2-acetyloxy-5-azanylidene-1-(phenylmethyl)-2H-imidazol-4-yl]carbonylamino]propanedioate

Systemtic Name: diethyl 2-[[2-acetyloxy-5-azanylidene-1-(phenylmethyl)-2H-imidazol-4-yl]carbonylamino]propanedioate Openeye Name: diethyl 2-[(2-acetoxy-1-benzyl-5-imino-2H-imidazole-4-carbonyl)amino]propanedioate CAS Name: 2-[[[2-acetyloxy-5-imino-1-(phenylmethyl)-2H-imidazol-4-yl]-oxomethyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2-acetyloxy-1-benzyl-5-imino-2H-imidazole-4-carbonyl)amino]propanedioate Traditional Name: 2-[(2-acetoxy-1-benzyl-5-imino-3-imidazoline-4-carbonyl)amino]malonic acid diethyl ester Formula: C20H24N4O7 MolecularWeight: 432.42716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)NC(=O)C1=NC(N(C1=N)CC2=CC=CC=C2)OC(=O)C

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NC(=O)C1=NC(N(C1=N)CC2=CC=CC=C2)OC(=O)C

InChI

InChI=1S/C20H24N4O7/c1-4-29-18(27)15(19(28)30-5-2)22-17(26)14-16(21)24(20(23-14)31-12(3)25)11-13-9-7-6-8-10-13/h6-10,15,20-21H,4-5,11H2,1-3H3,(H,22,26)