Benzamide, N-antipyrinyl-N-ethyl-m-nitro-

HCID 27112

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Basic information

CAS: 15166-20-8
Standard SMILES: CCN(C(=O)c1cccc([N+](=O)[O-])c1)c1c(C)n(C)n(-c2ccccc2)c1=O
InChIKey: NWSLNYKZGYKBFT-UHFFFAOYSA-N
Molecular formula: C20H20N4O4
Average molar mass: 380.4 g/mol
Monoisotopic mass: 380.14845513

Names & identifiers

Preferred name: Benzamide, N-antipyrinyl-N-ethyl-m-nitro-
IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N-ethyl-3-nitrobenzamide

Names & synonyms

15166-20-8BENZAMIDE, N-ANTIPYRINYL-N-ETHYL-m-NITRO-DTXSID70164845RefChem:1078130DTXCID3087336N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N-ethyl-3-nitrobenzamideTA 8N-Antipyrinyl-N-ethyl-m-nitrobenzamideBRN 0586658N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N-ethyl-3-nitrobenzamideOprea1_524198AB00105539-01

Show more names

SR-01000232473SR-01000232473-1

Database identifiers

CAS: 15166-20-8
PubChem CID: 27112
DTXSID: DTXSID70164845

Properties

Computed structural properties

XLogP: 3.4
Topological polar surface area: 89.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 4
Heavy atoms: 28
Formal charge: 0
Complexity: 666

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