5-(4-chlorophenyl)-4-heptyl-N-(4-nitrophenyl)-3,4-dihydropyrazole-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-4-heptyl-N-(4-nitrophenyl)-3,4-dihydropyrazole-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-4-heptyl-N-(4-nitrophenyl)-3,4-dihydropyrazole-2-carboxamide CAS Name: 5-(4-chlorophenyl)-4-heptyl-N-(4-nitrophenyl)-3,4-dihydropyrazole-2-carboxamide IUPAC Name: 5-(4-chlorophenyl)-4-heptyl-N-(4-nitrophenyl)-3,4-dihydropyrazole-2-carboxamide Traditional Name: 3-(4-chlorophenyl)-4-heptyl-N-(4-nitrophenyl)-2-pyrazoline-1-carboxamide Formula: C23H27ClN4O3 MolecularWeight: 442.93848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCC1CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H27ClN4O3/c1-2-3-4-5-6-7-18-16-27(26-22(18)17-8-10-19(24)11-9-17)23(29)25-20-12-14-21(15-13-20)28(30)31/h8-15,18H,2-7,16H2,1H3,(H,25,29)