2-[[4-(azepan-1-yl)phenyl]sulfamoyl]ethanoic acid

Systemtic Name: 2-[[4-(azepan-1-yl)phenyl]sulfamoyl]ethanoic acid Openeye Name: 2-[[4-(azepan-1-yl)phenyl]sulfamoyl]acetic acid CAS Name: 2-[[4-(1-azepanyl)phenyl]sulfamoyl]acetic acid IUPAC Name: 2-[[4-(azepan-1-yl)phenyl]sulfamoyl]acetic acid Traditional Name: 2-[[4-(azepan-1-yl)phenyl]sulfamoyl]acetic acid Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)CC(=O)O

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)CC(=O)O

InChI

InChI=1S/C14H20N2O4S/c17-14(18)11-21(19,20)15-12-5-7-13(8-6-12)16-9-3-1-2-4-10-16/h5-8,15H,1-4,9-11H2,(H,17,18)