1-(3,4-dimethoxyphenyl)-3-(5-nitrofuran-2-yl)pyrazole-4-carbonitrile

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-(5-nitrofuran-2-yl)pyrazole-4-carbonitrile Openeye Name: 1-(3,4-dimethoxyphenyl)-3-(5-nitro-2-furyl)pyrazole-4-carbonitrile CAS Name: 1-(3,4-dimethoxyphenyl)-3-(5-nitro-2-furanyl)-4-pyrazolecarbonitrile IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-(5-nitrofuran-2-yl)pyrazole-4-carbonitrile Traditional Name: 1-(3,4-dimethoxyphenyl)-3-(5-nitro-2-furyl)pyrazole-4-carbonitrile Formula: C16H12N4O5 MolecularWeight: 340.29028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])C#N)OC

InChI

InChI=1S/C16H12N4O5/c1-23-12-4-3-11(7-14(12)24-2)19-9-10(8-17)16(18-19)13-5-6-15(25-13)20(21)22/h3-7,9H,1-2H3