7-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylnaphthalen-1-yl]heptanoic acid

Systemtic Name: 7-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylnaphthalen-1-yl]heptanoic acid Openeye Name: 7-[2-(2-ethoxy-2-oxo-ethyl)sulfanyl-1-naphthyl]heptanoic acid CAS Name: 7-[2-[(2-ethoxy-2-oxoethyl)thio]-1-naphthalenyl]heptanoic acid IUPAC Name: 7-[2-(2-ethoxy-2-oxoethyl)sulfanylnaphthalen-1-yl]heptanoic acid Traditional Name: 7-[2-[(2-ethoxy-2-keto-ethyl)thio]-1-naphthyl]enanthic acid Formula: C21H26O4S MolecularWeight: 374.49374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C2=CC=CC=C2C=C1)CCCCCCC(=O)O

Isomeric SMILES

CCOC(=O)CSC1=C(C2=CC=CC=C2C=C1)CCCCCCC(=O)O

InChI

InChI=1S/C21H26O4S/c1-2-25-21(24)15-26-19-14-13-16-9-7-8-10-17(16)18(19)11-5-3-4-6-12-20(22)23/h7-10,13-14H,2-6,11-12,15H2,1H3,(H,22,23)