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3-(pentylamino)-4-phenoxy-5-sulfamoyl-benzoic acid

3-(pentylamino)-4-phenoxy-5-sulfamoyl-benzoic acid

Systemtic Name:3-(pentylamino)-4-phenoxy-5-sulfamoyl-benzoic acid
Openeye Name:3-(pentylamino)-4-phenoxy-5-sulfamoyl-benzoic acid
CAS Name:3-(pentylamino)-4-phenoxy-5-sulfamoylbenzoic acid
IUPAC Name:3-(pentylamino)-4-phenoxy-5-sulfamoylbenzoic acid
Traditional Name:3-(amylamino)-4-phenoxy-5-sulfamoyl-benzoic acid
Formula: C18H22N2O5S
MolecularWeight: 378.44268
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2


Isomeric SMILES

CCCCCNC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2


InChI

InChI=1S/C18H22N2O5S/c1-2-3-7-10-20-15-11-13(18(21)22)12-16(26(19,23)24)17(15)25-14-8-5-4-6-9-14/h4-6,8-9,11-12,20H,2-3,7,10H2,1H3,(H,21,22)(H2,19,23,24)


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