2-chloranyl-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-nitro-benzamide Formula: C14H15ClN4O3 MolecularWeight: 322.7469

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCN1C=C(C(=N1)C)CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H15ClN4O3/c1-3-18-8-10(9(2)17-18)7-16-14(20)12-5-4-11(19(21)22)6-13(12)15/h4-6,8H,3,7H2,1-2H3,(H,16,20)