2-(2,4-dichlorophenyl)-4-[4-(5-nitropyridin-2-yl)oxyphenoxy]-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(2,4-dichlorophenyl)-4-[4-(5-nitropyridin-2-yl)oxyphenoxy]-3-oxidanylidene-butanenitrile Openeye Name: 2-(2,4-dichlorophenyl)-4-[4-[(5-nitro-2-pyridyl)oxy]phenoxy]-3-oxo-butanenitrile CAS Name: 2-(2,4-dichlorophenyl)-4-[4-[(5-nitro-2-pyridinyl)oxy]phenoxy]-3-oxobutanenitrile IUPAC Name: 2-(2,4-dichlorophenyl)-4-[4-(5-nitropyridin-2-yl)oxyphenoxy]-3-oxobutanenitrile Traditional Name: 2-(2,4-dichlorophenyl)-3-keto-4-[4-[(5-nitro-2-pyridyl)oxy]phenoxy]butyronitrile Formula: C21H13Cl2N3O5 MolecularWeight: 458.25102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(=O)C(C#N)C2=C(C=C(C=C2)Cl)Cl)OC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1OCC(=O)C(C#N)C2=C(C=C(C=C2)Cl)Cl)OC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H13Cl2N3O5/c22-13-1-7-17(19(23)9-13)18(10-24)20(27)12-30-15-3-5-16(6-4-15)31-21-8-2-14(11-25-21)26(28)29/h1-9,11,18H,12H2