7-[2-[(4-methyl-5-methylsulfonyl-pentanoyl)amino]phenoxy]heptanoic acid

Systemtic Name: 7-[2-[(4-methyl-5-methylsulfonyl-pentanoyl)amino]phenoxy]heptanoic acid Openeye Name: 7-[2-[(4-methyl-5-methylsulfonyl-pentanoyl)amino]phenoxy]heptanoic acid CAS Name: 7-[2-[(4-methyl-5-methylsulfonyl-1-oxopentyl)amino]phenoxy]heptanoic acid IUPAC Name: 7-[2-[(4-methyl-5-methylsulfonylpentanoyl)amino]phenoxy]heptanoic acid Traditional Name: 7-[2-[(5-mesyl-4-methyl-pentanoyl)amino]phenoxy]enanthic acid Formula: C20H31NO6S MolecularWeight: 413.52824

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NC1=CC=CC=C1OCCCCCCC(=O)O)CS(=O)(=O)C

Isomeric SMILES

CC(CCC(=O)NC1=CC=CC=C1OCCCCCCC(=O)O)CS(=O)(=O)C

InChI

InChI=1S/C20H31NO6S/c1-16(15-28(2,25)26)12-13-19(22)21-17-9-6-7-10-18(17)27-14-8-4-3-5-11-20(23)24/h6-7,9-10,16H,3-5,8,11-15H2,1-2H3,(H,21,22)(H,23,24)