7-[methylsulfonyl(2-phenoxyethyl)amino]heptanoic acid

Systemtic Name: 7-[methylsulfonyl(2-phenoxyethyl)amino]heptanoic acid Openeye Name: 7-[methylsulfonyl(2-phenoxyethyl)amino]heptanoic acid CAS Name: 7-[methylsulfonyl(2-phenoxyethyl)amino]heptanoic acid IUPAC Name: 7-[methylsulfonyl(2-phenoxyethyl)amino]heptanoic acid Traditional Name: 7-[mesyl(2-phenoxyethyl)amino]enanthic acid Formula: C16H25NO5S MolecularWeight: 343.4384

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCCCCC(=O)O)CCOC1=CC=CC=C1

Isomeric SMILES

CS(=O)(=O)N(CCCCCCC(=O)O)CCOC1=CC=CC=C1

InChI

InChI=1S/C16H25NO5S/c1-23(20,21)17(12-8-3-2-7-11-16(18)19)13-14-22-15-9-5-4-6-10-15/h4-6,9-10H,2-3,7-8,11-14H2,1H3,(H,18,19)