N-[3-(cyclopropylmethoxy)propyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide

Systemtic Name: N-[3-(cyclopropylmethoxy)propyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Openeye Name: N-[3-(cyclopropylmethoxy)propyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide CAS Name: N-[3-(cyclopropylmethoxy)propyl]-1-(4-nitrophenyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-(cyclopropylmethoxy)propyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Traditional Name: N-[3-(cyclopropylmethoxy)propyl]-1-(4-nitrophenyl)pyrazole-4-carboxamide Formula: C17H20N4O4 MolecularWeight: 344.3651

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1COCCCNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1COCCCNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4/c22-17(18-8-1-9-25-12-13-2-3-13)14-10-19-20(11-14)15-4-6-16(7-5-15)21(23)24/h4-7,10-11,13H,1-3,8-9,12H2,(H,18,22)