Basic information
- CAS
206256-31-7- Standard SMILES
CCOC(=O)c1[nH]c2ccccc2c1S(=O)(=O)c1ccccc1N- InChIKey
FYWUYCYOZMJWPG-UHFFFAOYSA-N- Molecular formula
- C17H16N2O4S
- Average molar mass
- 344.4 g/mol
- Monoisotopic mass
- 344.08307817
Names & identifiers
- Preferred name
- 1H-Indole-2-carboxylic acid, 3-((2-aminophenyl)sulfonyl)-, ethyl ester
- IUPAC
- ethyl 3-(2-aminophenyl)sulfonyl-1H-indole-2-carboxylate
Names & synonyms
206256-31-7ethyl 3-[(2-aminophenyl)sulfonyl]-1h-indole-2-carboxylateEthyl 3-((2-aminophenyl)sulfonyl)-1H-indole-2-carboxylate1H-Indole-2-carboxylic acid, 3-((2-aminophenyl)sulfonyl)-, ethyl esterEthyl 3-((2-aminophenyl)sulfonyl)indole-2-carboxylateEthyl 3-[(2-aminophenyl)sulfonyl]indole-2-carboxylateethyl 3-(2-aminophenyl)sulfonyl-1H-indole-2-carboxylate1H-Indole-2-carboxylic acid, 3-[(2-aminophenyl)sulfonyl]-, ethyl esterDTXSID50174644Ethyl 3-(2-aminobenzene-1-sulfonyl)-1H-indole-2-carboxylate
Database identifiers
- CAS
206256-31-7- PubChem CID
- 469731
- DTXSID
DTXSID50174644
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 559
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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