N-[3-[1-cyano-2-(furan-2-ylmethylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]-4-nitro-benzamide

Systemtic Name: N-[3-[1-cyano-2-(furan-2-ylmethylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]-4-nitro-benzamide Openeye Name: N-[3-[1-cyano-2-(2-furylmethylamino)-2-oxo-ethylidene]isoindol-1-yl]-4-nitro-benzamide CAS Name: N-[3-[1-cyano-2-(2-furanylmethylamino)-2-oxoethylidene]-1-isoindolyl]-4-nitrobenzamide IUPAC Name: N-[3-[1-cyano-2-(furan-2-ylmethylamino)-2-oxoethylidene]isoindol-1-yl]-4-nitrobenzamide Traditional Name: N-[3-[1-cyano-2-(2-furfurylamino)-2-keto-ethylidene]isoindol-1-yl]-4-nitro-benzamide Formula: C23H15N5O5 MolecularWeight: 441.3957

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C#N)C(=O)NCC3=CC=CO3)N=C2NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C#N)C(=O)NCC3=CC=CO3)N=C2NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H15N5O5/c24-12-19(23(30)25-13-16-4-3-11-33-16)20-17-5-1-2-6-18(17)21(26-20)27-22(29)14-7-9-15(10-8-14)28(31)32/h1-11H,13H2,(H,25,30)(H,26,27,29)