N-[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]-5-ethoxy-4-methoxy-2-nitro-benzamide

Systemtic Name: N-[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]-5-ethoxy-4-methoxy-2-nitro-benzamide Openeye Name: N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridyl]-5-ethoxy-4-methoxy-2-nitro-benzamide CAS Name: N-[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridinyl]-5-ethoxy-4-methoxy-2-nitrobenzamide IUPAC Name: N-[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]-5-ethoxy-4-methoxy-2-nitrobenzamide Traditional Name: N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridyl]-5-ethoxy-4-methoxy-2-nitro-benzamide Formula: C20H21N5O5 MolecularWeight: 411.41124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)NC2=CN=C(C=C2)N3C(=CC(=N3)C)C)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)NC2=CN=C(C=C2)N3C(=CC(=N3)C)C)[N+](=O)[O-])OC

InChI

InChI=1S/C20H21N5O5/c1-5-30-18-9-15(16(25(27)28)10-17(18)29-4)20(26)22-14-6-7-19(21-11-14)24-13(3)8-12(2)23-24/h6-11H,5H2,1-4H3,(H,22,26)