3-nitro-4-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]benzamide

Systemtic Name: 3-nitro-4-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]benzamide Openeye Name: 3-nitro-4-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]benzamide CAS Name: 3-nitro-4-[[2-(1-pyrazolylmethyl)phenyl]methylamino]benzamide IUPAC Name: 3-nitro-4-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]benzamide Traditional Name: 3-nitro-4-[[2-(pyrazol-1-ylmethyl)benzyl]amino]benzamide Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])CN3C=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])CN3C=CC=N3

InChI

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