N'-(4-methylphenyl)-2-nitro-N-[[(Z)-(3-oxidanylidene-2-benzofuran-1-ylidene)methyl]amino]ethanimidamide

Systemtic Name: N'-(4-methylphenyl)-2-nitro-N-[[(Z)-(3-oxidanylidene-2-benzofuran-1-ylidene)methyl]amino]ethanimidamide Openeye Name: 2-nitro-N-[[(Z)-(3-oxoisobenzofuran-1-ylidene)methyl]amino]-N'-(p-tolyl)acetamidine CAS Name: N'-(4-methylphenyl)-2-nitro-N-[[(Z)-(3-oxo-1-isobenzofuranylidene)methyl]amino]ethanimidamide IUPAC Name: N'-(4-methylphenyl)-2-nitro-N-[[(Z)-(3-oxo-2-benzofuran-1-ylidene)methyl]amino]ethanimidamide Traditional Name: 2-nitro-N-[[(Z)-phthalidylidenemethyl]amino]-N'-(p-tolyl)acetamidine Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C(C[N+](=O)[O-])NNC=C2C3=CC=CC=C3C(=O)O2

Isomeric SMILES

CC1=CC=C(C=C1)N=C(C[N+](=O)[O-])NN/C=C\2/C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C18H16N4O4/c1-12-6-8-13(9-7-12)20-17(11-22(24)25)21-19-10-16-14-4-2-3-5-15(14)18(23)26-16/h2-10,19H,11H2,1H3,(H,20,21)/b16-10-