3-azanyl-4-(3-phenylpropyl)-5-sulfamoyl-benzoic acid

Systemtic Name: 3-azanyl-4-(3-phenylpropyl)-5-sulfamoyl-benzoic acid Openeye Name: 3-amino-4-(3-phenylpropyl)-5-sulfamoyl-benzoic acid CAS Name: 3-amino-4-(3-phenylpropyl)-5-sulfamoylbenzoic acid IUPAC Name: 3-amino-4-(3-phenylpropyl)-5-sulfamoylbenzoic acid Traditional Name: 3-amino-4-(3-phenylpropyl)-5-sulfamoyl-benzoic acid Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CCCC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N

InChI

InChI=1S/C16H18N2O4S/c17-14-9-12(16(19)20)10-15(23(18,21)22)13(14)8-4-7-11-5-2-1-3-6-11/h1-3,5-6,9-10H,4,7-8,17H2,(H,19,20)(H2,18,21,22)