4-(7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-ylsulfamoyl)benzoic acid

Systemtic Name: 4-(7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-ylsulfamoyl)benzoic acid Openeye Name: 4-(7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-ylsulfamoyl)benzoic acid CAS Name: 4-(7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-ylsulfamoyl)benzoic acid IUPAC Name: 4-(7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-ylsulfamoyl)benzoic acid Traditional Name: 4-(7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-ylsulfamoyl)benzoic acid Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=C(N2CC1)C=CC(=C3)NS(=O)(=O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CCC2=NC3=C(N2CC1)C=CC(=C3)NS(=O)(=O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C19H19N3O4S/c23-19(24)13-5-8-15(9-6-13)27(25,26)21-14-7-10-17-16(12-14)20-18-4-2-1-3-11-22(17)18/h5-10,12,21H,1-4,11H2,(H,23,24)