72D
Summary
Name: | 4-(phenyl)-benzenesulfonamide |
Synonyms: | [1,1'-biphenyl]-4-sulfonamide |
Formula: | C12 H11 N O2 S |
Formal charge: | 0 |
Formula weight: | 233.286 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | [1,1'-biphenyl]-4-sulfonamide |
OpenEye OEToolkits | 2.0.5 | 4-phenylbenzenesulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1cc(S(=O)(=O)N)ccc1c2ccccc2 |
InChI | InChI | 1.03 | InChI=1S/C12H11NO2S/c13-16(14,15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H2,13,14,15) |
InChIKey | InChI | 1.03 | JVFCCRJSBNUDDU-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)c2ccccc2 |
SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)c2ccccc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1ccc(cc1)c2ccc(cc2)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 2.0.5 | c1ccc(cc1)c2ccc(cc2)S(=O)(=O)N |