1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-[3-(diethylamino)propyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-[3-(diethylamino)propyl]pyrazole-3-carboxamide Openeye Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-[3-(diethylamino)propyl]pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-[3-(diethylamino)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-[3-(diethylamino)propyl]pyrazole-3-carboxamide Traditional Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-[3-(diethylamino)propyl]pyrazole-3-carboxamide Formula: C18H24ClN5O4 MolecularWeight: 409.86726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCN(CC)CCCNC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H24ClN5O4/c1-3-22(4-2)10-5-9-20-18(25)16-8-11-23(21-16)13-28-17-7-6-14(24(26)27)12-15(17)19/h6-8,11-12H,3-5,9-10,13H2,1-2H3,(H,20,25)