4-[(4-chloranyl-3-nitro-pyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]benzamide

Systemtic Name: 4-[(4-chloranyl-3-nitro-pyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]benzamide Openeye Name: 4-[(4-chloro-3-nitro-pyrazol-1-yl)methyl]-N-[4-(1-piperidylmethyl)phenyl]benzamide CAS Name: 4-[(4-chloro-3-nitro-1-pyrazolyl)methyl]-N-[4-(1-piperidinylmethyl)phenyl]benzamide IUPAC Name: 4-[(4-chloro-3-nitropyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]benzamide Traditional Name: 4-[(4-chloro-3-nitro-pyrazol-1-yl)methyl]-N-[4-(piperidinomethyl)phenyl]benzamide Formula: C23H24ClN5O3 MolecularWeight: 453.92136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4C=C(C(=N4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4C=C(C(=N4)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H24ClN5O3/c24-21-16-28(26-22(21)29(31)32)15-18-4-8-19(9-5-18)23(30)25-20-10-6-17(7-11-20)14-27-12-2-1-3-13-27/h4-11,16H,1-3,12-15H2,(H,25,30)