4-azanyl-3-nitro-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-azanyl-3-nitro-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-amino-3-nitro-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-amino-3-nitro-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-amino-3-nitro-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-amino-3-nitro-N-[4-(pyrazol-1-ylmethyl)benzyl]benzamide Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1=CN(N=C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O3/c19-16-7-6-15(10-17(16)23(25)26)18(24)20-11-13-2-4-14(5-3-13)12-22-9-1-8-21-22/h1-10H,11-12,19H2,(H,20,24)