Formula |
C20H18N2O5S |
IUPAC Name |
3-(benzylamino)-4-phenoxy-5-sulfamoyl-benzoic acid |
Molecular Mass |
398.432 g·mol−1 |
Heat of Formation |
-555.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.33 ± 1.08 D |
Volume |
445.12 Å 3 |
Surface Area |
347.08 Å 2 |
HOMO Energy |
-9.01 ± 0.55 eV |
LUMO Energy |
-1.17 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-(benzylamino)-4-(phenoxy)-5-sulfamoyl-benzoic acid
- 3-benzylamino-4-phenoxy-5-sulfamoylbenzoic acid
- 4-(phenoxy)-3-(phenylmethylamino)-5-sulfamoyl-benzoic acid
- 4-(phenoxy)-3-(phenylmethylamino)-5-sulfamoylbenzoic acid
- benzmetanide
- benzoic acid, 3-(aminosulfonyl)-4-phenoxy-5-((phenylmethyl)amino)-
- h 25
- h-25
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CAS Number(s) |
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InChIKey |
UCNWQTMKAPAUHU-UHFFFAOYSA-N |
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Links |
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DOI |
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Downloads |
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Elements |
H
S
C
O
N
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