2-phenylsulfanylethyl 7-chloranyl-2,4-bis(oxidanylidene)-1H-quinoline-3-carboxylate

Systemtic Name: 2-phenylsulfanylethyl 7-chloranyl-2,4-bis(oxidanylidene)-1H-quinoline-3-carboxylate Openeye Name: 2-phenylsulfanylethyl 7-chloro-2,4-dioxo-1H-quinoline-3-carboxylate CAS Name: 7-chloro-2,4-dioxo-1H-quinoline-3-carboxylic acid 2-(phenylthio)ethyl ester IUPAC Name: 2-phenylsulfanylethyl 7-chloro-2,4-dioxo-1H-quinoline-3-carboxylate Traditional Name: 7-chloro-2,4-diketo-1H-quinoline-3-carboxylic acid 2-(phenylthio)ethyl ester Formula: C18H14ClNO4S MolecularWeight: 375.82606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCOC(=O)C2C(=O)C3=C(C=C(C=C3)Cl)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)SCCOC(=O)C2C(=O)C3=C(C=C(C=C3)Cl)NC2=O

InChI

InChI=1S/C18H14ClNO4S/c19-11-6-7-13-14(10-11)20-17(22)15(16(13)21)18(23)24-8-9-25-12-4-2-1-3-5-12/h1-7,10,15H,8-9H2,(H,20,22)