[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-(5-chloro-2-thienyl)-2-oxo-ethyl] 2-[(2-chloro-5-nitro-benzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-(5-chloro-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-chlorothiophen-2-yl)-2-oxoethyl] 2-[(2-chloro-5-nitrobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2-chloro-5-nitro-benzoyl)amino]-3-methyl-butyric acid [2-(5-chloro-2-thienyl)-2-keto-ethyl] ester Formula: C18H16Cl2N2O6S MolecularWeight: 459.30044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C1=CC=C(S1)Cl)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)C1=CC=C(S1)Cl)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H16Cl2N2O6S/c1-9(2)16(18(25)28-8-13(23)14-5-6-15(20)29-14)21-17(24)11-7-10(22(26)27)3-4-12(11)19/h3-7,9,16H,8H2,1-2H3,(H,21,24)