N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C18H13ClN4O5 MolecularWeight: 400.77262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Cl)NC(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Cl)NC(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H13ClN4O5/c19-13-9-16-17(28-7-6-27-16)10-15(13)20-18(24)14-4-5-22(21-14)11-2-1-3-12(8-11)23(25)26/h1-5,8-10H,6-7H2,(H,20,24)