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3,4-dihydro-1-oxo-1H-pyrrolo[2,1-c][1,4]oxazine-8-sulfonamide

HCID 18960413
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
NS(=O)(=O)c1ccn2c1C(=O)OCC2
InChIKey
UYAOLWSUELTYSH-UHFFFAOYSA-N
Molecular formula
C7H8N2O4S
Average molar mass
216.22 g/mol

Names & identifiers

Preferred name
3,4-dihydro-1-oxo-1H-pyrrolo[2,1-c][1,4]oxazine-8-sulfonamide
IUPAC
1-oxo-3,4-dihydropyrrolo[2,1-c][1,4]oxazine-8-sulfonamide

Names & synonyms

SCHEMBL9426594UYAOLWSUELTYSH-UHFFFAOYSA-N3,4-dihydro-1-oxo-1H-pyrrolo[2,1-c][1,4]oxazine-8-sulfonamide

Database identifiers

PubChem CID
18960413

Properties

Computed structural properties

XLogP
-0.9
Topological polar surface area
99.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
14
Formal charge
0
Complexity
347

Related reactions

2 records
New reaction record
HRID 108856 reaction equation
HRID 108856As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1707930 reaction equation
HRID 1707930As reactantuspto-grants-1994_10

Compound notes

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