methyl 3-(3-chloranylpropylamino)-4-phenoxy-5-sulfamoyl-benzoate

Systemtic Name: methyl 3-(3-chloranylpropylamino)-4-phenoxy-5-sulfamoyl-benzoate Openeye Name: methyl 3-(3-chloropropylamino)-4-phenoxy-5-sulfamoyl-benzoate CAS Name: 3-(3-chloropropylamino)-4-phenoxy-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 3-(3-chloropropylamino)-4-phenoxy-5-sulfamoylbenzoate Traditional Name: 3-(3-chloropropylamino)-4-phenoxy-5-sulfamoyl-benzoic acid methyl ester Formula: C17H19ClN2O5S MolecularWeight: 398.86116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N)OC2=CC=CC=C2)NCCCCl

Isomeric SMILES

COC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N)OC2=CC=CC=C2)NCCCCl

InChI

InChI=1S/C17H19ClN2O5S/c1-24-17(21)12-10-14(20-9-5-8-18)16(15(11-12)26(19,22)23)25-13-6-3-2-4-7-13/h2-4,6-7,10-11,20H,5,8-9H2,1H3,(H2,19,22,23)