6-methyl-4-(naphthalen-1-ylsulfonylamino)-5-oxidanylidene-heptanoic acid

Systemtic Name: 6-methyl-4-(naphthalen-1-ylsulfonylamino)-5-oxidanylidene-heptanoic acid Openeye Name: 6-methyl-4-(1-naphthylsulfonylamino)-5-oxo-heptanoic acid CAS Name: 6-methyl-4-(1-naphthalenylsulfonylamino)-5-oxoheptanoic acid IUPAC Name: 6-methyl-4-(naphthalen-1-ylsulfonylamino)-5-oxoheptanoic acid Traditional Name: 5-keto-6-methyl-4-(1-naphthylsulfonylamino)enanthic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(CCC(=O)O)NS(=O)(=O)C1=CC=CC2=CC=CC=C21

Isomeric SMILES

CC(C)C(=O)C(CCC(=O)O)NS(=O)(=O)C1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C18H21NO5S/c1-12(2)18(22)15(10-11-17(20)21)19-25(23,24)16-9-5-7-13-6-3-4-8-14(13)16/h3-9,12,15,19H,10-11H2,1-2H3,(H,20,21)