ethyl 2-[3-azanyl-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-azanyl-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[(3-amino-1,4-dioxo-2-naphthyl)sulfanyl]acetate CAS Name: 2-[(3-amino-1,4-dioxo-2-naphthalenyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(3-amino-1,4-dioxonaphthalen-2-yl)sulfanylacetate Traditional Name: 2-[(3-amino-1,4-diketo-2-naphthyl)thio]acetic acid ethyl ester Formula: C14H13NO4S MolecularWeight: 291.32232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(=O)C2=CC=CC=C2C1=O)N

Isomeric SMILES

CCOC(=O)CSC1=C(C(=O)C2=CC=CC=C2C1=O)N

InChI

InChI=1S/C14H13NO4S/c1-2-19-10(16)7-20-14-11(15)12(17)8-5-3-4-6-9(8)13(14)18/h3-6H,2,7,15H2,1H3