3-[3-(cyclohexa-1,5-dien-1-ylsulfonylamino)phenyl]propanoic acid

Systemtic Name: 3-[3-(cyclohexa-1,5-dien-1-ylsulfonylamino)phenyl]propanoic acid Openeye Name: 3-[3-(cyclohexa-1,5-dien-1-ylsulfonylamino)phenyl]propanoic acid CAS Name: 3-[3-(1-cyclohexa-1,5-dienylsulfonylamino)phenyl]propanoic acid IUPAC Name: 3-[3-(cyclohexa-1,5-dien-1-ylsulfonylamino)phenyl]propanoic acid Traditional Name: 3-[3-(cyclohexa-1,5-dien-1-ylsulfonylamino)phenyl]propionic acid Formula: C15H17NO4S MolecularWeight: 307.36478

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CCC(=O)O

Isomeric SMILES

C1CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CCC(=O)O

InChI

InChI=1S/C15H17NO4S/c17-15(18)10-9-12-5-4-6-13(11-12)16-21(19,20)14-7-2-1-3-8-14/h2,4-8,11,16H,1,3,9-10H2,(H,17,18)