N-(3,4-dimethylphenyl)-3-nitro-4-pyrazol-1-yl-benzamide

Systemtic Name: N-(3,4-dimethylphenyl)-3-nitro-4-pyrazol-1-yl-benzamide Openeye Name: N-(3,4-dimethylphenyl)-3-nitro-4-pyrazol-1-yl-benzamide CAS Name: N-(3,4-dimethylphenyl)-3-nitro-4-(1-pyrazolyl)benzamide IUPAC Name: N-(3,4-dimethylphenyl)-3-nitro-4-pyrazol-1-ylbenzamide Traditional Name: N-(3,4-dimethylphenyl)-3-nitro-4-pyrazol-1-yl-benzamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=CC=N3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=CC=N3)[N+](=O)[O-])C

InChI

InChI=1S/C18H16N4O3/c1-12-4-6-15(10-13(12)2)20-18(23)14-5-7-16(17(11-14)22(24)25)21-9-3-8-19-21/h3-11H,1-2H3,(H,20,23)