1-[(2-nitrophenoxy)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(2-nitrophenoxy)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(2-nitrophenoxy)methyl]-N-[4-(1-piperidylmethyl)phenyl]pyrazole-3-carboxamide CAS Name: 1-[(2-nitrophenoxy)methyl]-N-[4-(1-piperidinylmethyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(2-nitrophenoxy)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide Traditional Name: 1-[(2-nitrophenoxy)methyl]-N-[4-(piperidinomethyl)phenyl]pyrazole-3-carboxamide Formula: C23H25N5O4 MolecularWeight: 435.4757

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H25N5O4/c29-23(24-19-10-8-18(9-11-19)16-26-13-4-1-5-14-26)20-12-15-27(25-20)17-32-22-7-3-2-6-21(22)28(30)31/h2-3,6-12,15H,1,4-5,13-14,16-17H2,(H,24,29)