N-[(E)-[4-[bis(2-cyanoethyl)amino]phenyl]methylideneamino]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[(E)-[4-[bis(2-cyanoethyl)amino]phenyl]methylideneamino]-5-nitro-furan-2-carboxamide Openeye Name: N-[(E)-[4-[bis(2-cyanoethyl)amino]phenyl]methyleneamino]-5-nitro-furan-2-carboxamide CAS Name: N-[(E)-[4-[bis(2-cyanoethyl)amino]phenyl]methylideneamino]-5-nitro-2-furancarboxamide IUPAC Name: N-[(E)-[4-[bis(2-cyanoethyl)amino]phenyl]methylideneamino]-5-nitrofuran-2-carboxamide Traditional Name: N-[(E)-[4-[bis(2-cyanoethyl)amino]benzylidene]amino]-5-nitro-2-furamide Formula: C18H16N6O4 MolecularWeight: 380.35744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC(=O)C2=CC=C(O2)[N+](=O)[O-])N(CCC#N)CCC#N

Isomeric SMILES

C1=CC(=CC=C1/C=N/NC(=O)C2=CC=C(O2)[N+](=O)[O-])N(CCC#N)CCC#N

InChI

InChI=1S/C18H16N6O4/c19-9-1-11-23(12-2-10-20)15-5-3-14(4-6-15)13-21-22-18(25)16-7-8-17(28-16)24(26)27/h3-8,13H,1-2,11-12H2,(H,22,25)/b21-13+