N-[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[4-[(3-cyano-2-pyridinyl)oxy]-2-methylphenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[4-(3-cyanopyridin-2-yl)oxy-2-methylphenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]-4-methyl-3-nitro-benzamide Formula: C21H16N4O4 MolecularWeight: 388.37614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)OC3=C(C=CC=N3)C#N)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)OC3=C(C=CC=N3)C#N)C)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O4/c1-13-5-6-15(11-19(13)25(27)28)20(26)24-18-8-7-17(10-14(18)2)29-21-16(12-22)4-3-9-23-21/h3-11H,1-2H3,(H,24,26)