N-[3-(morpholin-4-ylmethyl)phenyl]-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[3-(morpholin-4-ylmethyl)phenyl]-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[3-(morpholinomethyl)phenyl]-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[3-(4-morpholinylmethyl)phenyl]-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[3-(morpholin-4-ylmethyl)phenyl]-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[3-(morpholinomethyl)phenyl]-4-nitro-1H-pyrazole-5-carboxamide Formula: C15H17N5O4 MolecularWeight: 331.32658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC(=CC=C2)NC(=O)C3=C(C=NN3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CC2=CC(=CC=C2)NC(=O)C3=C(C=NN3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O4/c21-15(14-13(20(22)23)9-16-18-14)17-12-3-1-2-11(8-12)10-19-4-6-24-7-5-19/h1-3,8-9H,4-7,10H2,(H,16,18)(H,17,21)