N-(2,5-dimethylpyrazol-3-yl)-3-nitro-4-phenylazanyl-benzamide

Systemtic Name: N-(2,5-dimethylpyrazol-3-yl)-3-nitro-4-phenylazanyl-benzamide Openeye Name: 4-anilino-N-(2,5-dimethylpyrazol-3-yl)-3-nitro-benzamide CAS Name: 4-anilino-N-(2,5-dimethyl-3-pyrazolyl)-3-nitrobenzamide IUPAC Name: 4-anilino-N-(2,5-dimethylpyrazol-3-yl)-3-nitrobenzamide Traditional Name: 4-anilino-N-(2,5-dimethylpyrazol-3-yl)-3-nitro-benzamide Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC(=C(C=C2)NC3=CC=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC(=C(C=C2)NC3=CC=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H17N5O3/c1-12-10-17(22(2)21-12)20-18(24)13-8-9-15(16(11-13)23(25)26)19-14-6-4-3-5-7-14/h3-11,19H,1-2H3,(H,20,24)