5-[[4-(azepan-1-yl)phenyl]sulfonylamino]pentanoic acid

Systemtic Name: 5-[[4-(azepan-1-yl)phenyl]sulfonylamino]pentanoic acid Openeye Name: 5-[[4-(azepan-1-yl)phenyl]sulfonylamino]pentanoic acid CAS Name: 5-[[4-(1-azepanyl)phenyl]sulfonylamino]pentanoic acid IUPAC Name: 5-[[4-(azepan-1-yl)phenyl]sulfonylamino]pentanoic acid Traditional Name: 5-[[4-(azepan-1-yl)phenyl]sulfonylamino]valeric acid Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)S(=O)(=O)NCCCCC(=O)O

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)S(=O)(=O)NCCCCC(=O)O

InChI

InChI=1S/C17H26N2O4S/c20-17(21)7-3-4-12-18-24(22,23)16-10-8-15(9-11-16)19-13-5-1-2-6-14-19/h8-11,18H,1-7,12-14H2,(H,20,21)