7-[2-(4-butylphenyl)ethylsulfonylamino]heptanoic acid

Systemtic Name: 7-[2-(4-butylphenyl)ethylsulfonylamino]heptanoic acid Openeye Name: 7-[2-(4-butylphenyl)ethylsulfonylamino]heptanoic acid CAS Name: 7-[2-(4-butylphenyl)ethylsulfonylamino]heptanoic acid IUPAC Name: 7-[2-(4-butylphenyl)ethylsulfonylamino]heptanoic acid Traditional Name: 7-[2-(4-butylphenyl)ethylsulfonylamino]enanthic acid Formula: C19H31NO4S MolecularWeight: 369.51874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CCS(=O)(=O)NCCCCCCC(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)CCS(=O)(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C19H31NO4S/c1-2-3-8-17-10-12-18(13-11-17)14-16-25(23,24)20-15-7-5-4-6-9-19(21)22/h10-13,20H,2-9,14-16H2,1H3,(H,21,22)