6-[2-[5-(3-chloranyl-4-methoxy-phenyl)furan-2-yl]ethenyl]-4-(methoxymethyl)-5-nitro-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 6-[2-[5-(3-chloranyl-4-methoxy-phenyl)furan-2-yl]ethenyl]-4-(methoxymethyl)-5-nitro-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 6-[2-[5-(3-chloro-4-methoxy-phenyl)-2-furyl]vinyl]-4-(methoxymethyl)-5-nitro-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 6-[2-[5-(3-chloro-4-methoxyphenyl)-2-furanyl]ethenyl]-4-(methoxymethyl)-5-nitro-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 6-[2-[5-(3-chloro-4-methoxyphenyl)furan-2-yl]ethenyl]-4-(methoxymethyl)-5-nitro-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 6-[2-[5-(3-chloro-4-methoxy-phenyl)-2-furyl]vinyl]-2-keto-4-(methoxymethyl)-5-nitro-1H-pyridine-3-carbonitrile Formula: C21H16ClN3O6 MolecularWeight: 441.82124

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(C(=O)NC(=C1[N+](=O)[O-])C=CC2=CC=C(O2)C3=CC(=C(C=C3)OC)Cl)C#N

Isomeric SMILES

COCC1=C(C(=O)NC(=C1[N+](=O)[O-])C=CC2=CC=C(O2)C3=CC(=C(C=C3)OC)Cl)C#N

InChI

InChI=1S/C21H16ClN3O6/c1-29-11-15-14(10-23)21(26)24-17(20(15)25(27)28)6-4-13-5-8-18(31-13)12-3-7-19(30-2)16(22)9-12/h3-9H,11H2,1-2H3,(H,24,26)