3-[4-(heptanoylamino)phenyl]propane-1-sulfonate

Systemtic Name: 3-[4-(heptanoylamino)phenyl]propane-1-sulfonate Openeye Name: 3-[4-(heptanoylamino)phenyl]propane-1-sulfonate CAS Name: 3-[4-(1-oxoheptylamino)phenyl]-1-propanesulfonate IUPAC Name: 3-[4-(heptanoylamino)phenyl]propane-1-sulfonate Traditional Name: 3-[4-(enanthylamino)phenyl]propane-1-sulfonate Formula: C16H24NO4S- MolecularWeight: 326.43106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=CC=C(C=C1)CCCS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCC(=O)NC1=CC=C(C=C1)CCCS(=O)(=O)[O-]

InChI

InChI=1S/C16H25NO4S/c1-2-3-4-5-8-16(18)17-15-11-9-14(10-12-15)7-6-13-22(19,20)21/h9-12H,2-8,13H2,1H3,(H,17,18)(H,19,20,21)/p-1