ethyl 6-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-thiomorpholine-3-carboxylate

Systemtic Name: ethyl 6-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-thiomorpholine-3-carboxylate Openeye Name: ethyl 6-[2-(3-nitroanilino)-2-oxo-ethyl]-5-oxo-thiomorpholine-3-carboxylate CAS Name: 6-[2-(3-nitroanilino)-2-oxoethyl]-5-oxo-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[2-(3-nitroanilino)-2-oxoethyl]-5-oxothiomorpholine-3-carboxylate Traditional Name: 5-keto-6-[2-keto-2-(3-nitroanilino)ethyl]thiomorpholine-3-carboxylic acid ethyl ester Formula: C15H17N3O6S MolecularWeight: 367.37698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC(C(=O)N1)CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CSC(C(=O)N1)CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O6S/c1-2-24-15(21)11-8-25-12(14(20)17-11)7-13(19)16-9-4-3-5-10(6-9)18(22)23/h3-6,11-12H,2,7-8H2,1H3,(H,16,19)(H,17,20)