[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate

Systemtic Name: [2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate Openeye Name: [2-(4-nitroanilino)-2-oxo-ethyl] 2-[(5-chloro-2-thienyl)methylsulfanyl]acetate CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]acetic acid [2-(4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-nitroanilino)-2-oxoethyl] 2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]acetic acid [2-keto-2-(4-nitroanilino)ethyl] ester Formula: C15H13ClN2O5S2 MolecularWeight: 400.85712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)COC(=O)CSCC2=CC=C(S2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)COC(=O)CSCC2=CC=C(S2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H13ClN2O5S2/c16-13-6-5-12(25-13)8-24-9-15(20)23-7-14(19)17-10-1-3-11(4-2-10)18(21)22/h1-6H,7-9H2,(H,17,19)