methyl 4-[2-(4-aminocarbonyl-5-ethanoylimino-imidazol-2-yl)hydrazinyl]benzoate

Systemtic Name: methyl 4-[2-(4-aminocarbonyl-5-ethanoylimino-imidazol-2-yl)hydrazinyl]benzoate Openeye Name: methyl 4-[2-(4-acetylimino-5-carbamoyl-imidazol-2-yl)hydrazino]benzoate CAS Name: 4-[(4-acetylimino-5-carbamoyl-2-imidazolyl)hydrazo]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(4-acetylimino-5-carbamoylimidazol-2-yl)hydrazinyl]benzoate Traditional Name: 4-[N'-(4-acetylimino-5-carbamoyl-imidazol-2-yl)hydrazino]benzoic acid methyl ester Formula: C14H14N6O4 MolecularWeight: 330.29876

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N=C1C(=NC(=N1)NNC2=CC=C(C=C2)C(=O)OC)C(=O)N

Isomeric SMILES

CC(=O)N=C1C(=NC(=N1)NNC2=CC=C(C=C2)C(=O)OC)C(=O)N

InChI

InChI=1S/C14H14N6O4/c1-7(21)16-12-10(11(15)22)17-14(18-12)20-19-9-5-3-8(4-6-9)13(23)24-2/h3-6,19H,1-2H3,(H2,15,22)(H,16,18,20,21)