2-(ethylamino)-4-(phenylmethyl)-5-sulfamoyl-benzoic acid

Systemtic Name: 2-(ethylamino)-4-(phenylmethyl)-5-sulfamoyl-benzoic acid Openeye Name: 4-benzyl-2-(ethylamino)-5-sulfamoyl-benzoic acid CAS Name: 2-(ethylamino)-4-(phenylmethyl)-5-sulfamoylbenzoic acid IUPAC Name: 4-benzyl-2-(ethylamino)-5-sulfamoylbenzoic acid Traditional Name: 4-benzyl-2-(ethylamino)-5-sulfamoyl-benzoic acid Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)CC2=CC=CC=C2

Isomeric SMILES

CCNC1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O4S/c1-2-18-14-9-12(8-11-6-4-3-5-7-11)15(23(17,21)22)10-13(14)16(19)20/h3-7,9-10,18H,2,8H2,1H3,(H,19,20)(H2,17,21,22)