4-[3-(3-nitro-2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxypropoxy]benzenecarbonitrile

Systemtic Name: 4-[3-(3-nitro-2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxypropoxy]benzenecarbonitrile Openeye Name: 4-[3-(2-hydroxy-3-nitro-4-oxo-chromen-7-yl)oxypropoxy]benzonitrile CAS Name: 4-[3-[(2-hydroxy-3-nitro-4-oxo-1-benzopyran-7-yl)oxy]propoxy]benzonitrile IUPAC Name: 4-[3-(2-hydroxy-3-nitro-4-oxochromen-7-yl)oxypropoxy]benzonitrile Traditional Name: 4-[3-(2-hydroxy-4-keto-3-nitro-chromen-7-yl)oxypropoxy]benzonitrile Formula: C19H14N2O7 MolecularWeight: 382.32366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#N)OCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-]

InChI

InChI=1S/C19H14N2O7/c20-11-12-2-4-13(5-3-12)26-8-1-9-27-14-6-7-15-16(10-14)28-19(23)17(18(15)22)21(24)25/h2-7,10,23H,1,8-9H2