3-(4-chloranyl-3-nitro-pyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide

Systemtic Name: 3-(4-chloranyl-3-nitro-pyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide Openeye Name: 3-(4-chloro-3-nitro-pyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide CAS Name: 3-(4-chloro-3-nitro-1-pyrazolyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide IUPAC Name: 3-(4-chloro-3-nitropyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide Traditional Name: 3-(4-chloro-3-nitro-pyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propionamide Formula: C14H13ClN4O5 MolecularWeight: 352.72982

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H13ClN4O5/c15-10-8-18(17-14(10)19(21)22)4-3-13(20)16-9-1-2-11-12(7-9)24-6-5-23-11/h1-2,7-8H,3-6H2,(H,16,20)