2-[2-[[1-(3-methylbutyl)cyclopentyl]carbonylamino]phenyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[[1-(3-methylbutyl)cyclopentyl]carbonylamino]phenyl]sulfanylethanoic acid Openeye Name: 2-[2-[(1-isopentylcyclopentanecarbonyl)amino]phenyl]sulfanylacetic acid CAS Name: 2-[[2-[[[1-(3-methylbutyl)cyclopentyl]-oxomethyl]amino]phenyl]thio]acetic acid IUPAC Name: 2-[2-[[1-(3-methylbutyl)cyclopentanecarbonyl]amino]phenyl]sulfanylacetic acid Traditional Name: 2-[[2-[(1-isoamylcyclopentanecarbonyl)amino]phenyl]thio]acetic acid Formula: C19H27NO3S MolecularWeight: 349.48758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(CCCC1)C(=O)NC2=CC=CC=C2SCC(=O)O

Isomeric SMILES

CC(C)CCC1(CCCC1)C(=O)NC2=CC=CC=C2SCC(=O)O

InChI

InChI=1S/C19H27NO3S/c1-14(2)9-12-19(10-5-6-11-19)18(23)20-15-7-3-4-8-16(15)24-13-17(21)22/h3-4,7-8,14H,5-6,9-13H2,1-2H3,(H,20,23)(H,21,22)