3-(dipentylamino)-4-phenoxy-5-sulfamoyl-benzoate

Systemtic Name: 3-(dipentylamino)-4-phenoxy-5-sulfamoyl-benzoate Openeye Name: 3-(dipentylamino)-4-phenoxy-5-sulfamoyl-benzoate CAS Name: 3-(dipentylamino)-4-phenoxy-5-sulfamoylbenzoate IUPAC Name: 3-(dipentylamino)-4-phenoxy-5-sulfamoylbenzoate Traditional Name: 3-(diamylamino)-4-phenoxy-5-sulfamoyl-benzoate Formula: C23H31N2O5S- MolecularWeight: 447.56764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)N)OC2=CC=CC=C2

Isomeric SMILES

CCCCCN(CCCCC)C1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)N)OC2=CC=CC=C2

InChI

InChI=1S/C23H32N2O5S/c1-3-5-10-14-25(15-11-6-4-2)20-16-18(23(26)27)17-21(31(24,28)29)22(20)30-19-12-8-7-9-13-19/h7-9,12-13,16-17H,3-6,10-11,14-15H2,1-2H3,(H,26,27)(H2,24,28,29)/p-1