Basic information
- CAS
14193-10-3- Standard SMILES
O=C(Nc1ccc(S(=O)(=O)c2ccccc2)cc1)Oc1ccccc1[N+](=O)[O-]- InChIKey
QVJYFEUQAPBHJE-UHFFFAOYSA-N- Molecular formula
- C19H14N2O6S
- Average molar mass
- 398.4 g/mol
- Monoisotopic mass
- 398.05725734
Names & identifiers
- Preferred name
- Carbanilic acid, p-(phenylsulfonyl)-, o-nitrophenyl ester
- IUPAC
- (2-nitrophenyl) N-[4-(benzenesulfonyl)phenyl]carbamate
Names & synonyms
BRN 3015803CARBANILIC ACID, p-(PHENYLSULFONYL)-, o-NITROPHENYL ESTERp-(Phenylsulfonyl)carbanilic acid o-nitrophenyl ester14193-10-3DTXSID20161864RefChem:333157DTXCID00843552-Nitrophenyl [4-(benzenesulfonyl)phenyl]carbamate
Database identifiers
- CAS
14193-10-3- PubChem CID
- 26554
- DTXSID
DTXSID20161864
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 642
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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