7-[3-(3-chloranyl-5-methoxy-phenoxy)propyl-methylsulfonyl-amino]heptanoic acid

Systemtic Name: 7-[3-(3-chloranyl-5-methoxy-phenoxy)propyl-methylsulfonyl-amino]heptanoic acid Openeye Name: 7-[3-(3-chloro-5-methoxy-phenoxy)propyl-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[3-(3-chloro-5-methoxyphenoxy)propyl-methylsulfonylamino]heptanoic acid IUPAC Name: 7-[3-(3-chloro-5-methoxyphenoxy)propyl-methylsulfonylamino]heptanoic acid Traditional Name: 7-[3-(3-chloro-5-methoxy-phenoxy)propyl-mesyl-amino]enanthic acid Formula: C18H28ClNO6S MolecularWeight: 421.93602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)Cl)OCCCN(CCCCCCC(=O)O)S(=O)(=O)C

Isomeric SMILES

COC1=CC(=CC(=C1)Cl)OCCCN(CCCCCCC(=O)O)S(=O)(=O)C

InChI

InChI=1S/C18H28ClNO6S/c1-25-16-12-15(19)13-17(14-16)26-11-7-10-20(27(2,23)24)9-6-4-3-5-8-18(21)22/h12-14H,3-11H2,1-2H3,(H,21,22)