ethyl 2-[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylpropanoate

Systemtic Name: ethyl 2-[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylpropanoate Openeye Name: ethyl 2-[(3-chloro-1,4-dioxo-2-naphthyl)sulfanyl]propanoate CAS Name: 2-[(3-chloro-1,4-dioxo-2-naphthalenyl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-(3-chloro-1,4-dioxonaphthalen-2-yl)sulfanylpropanoate Traditional Name: 2-[(3-chloro-1,4-diketo-2-naphthyl)thio]propionic acid ethyl ester Formula: C15H13ClO4S MolecularWeight: 324.77932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

Isomeric SMILES

CCOC(=O)C(C)SC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

InChI

InChI=1S/C15H13ClO4S/c1-3-20-15(19)8(2)21-14-11(16)12(17)9-6-4-5-7-10(9)13(14)18/h4-8H,3H2,1-2H3