4-azanyl-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide

Systemtic Name: 4-azanyl-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Openeye Name: 4-amino-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide CAS Name: 4-amino-3-nitro-N-[(1-phenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 4-amino-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Traditional Name: 4-amino-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Formula: C17H15N5O3 MolecularWeight: 337.3327

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O3/c18-15-7-6-13(8-16(15)22(24)25)17(23)19-9-12-10-20-21(11-12)14-4-2-1-3-5-14/h1-8,10-11H,9,18H2,(H,19,23)