ethyl 4-(2-chloranyl-4-nitro-phenyl)carbonylthiomorpholine-3-carboxylate

Systemtic Name: ethyl 4-(2-chloranyl-4-nitro-phenyl)carbonylthiomorpholine-3-carboxylate Openeye Name: ethyl 4-(2-chloro-4-nitro-benzoyl)thiomorpholine-3-carboxylate CAS Name: 4-[(2-chloro-4-nitrophenyl)-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-4-nitrobenzoyl)thiomorpholine-3-carboxylate Traditional Name: 4-(2-chloro-4-nitro-benzoyl)thiomorpholine-3-carboxylic acid ethyl ester Formula: C14H15ClN2O5S MolecularWeight: 358.7973

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCN1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C1CSCCN1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H15ClN2O5S/c1-2-22-14(19)12-8-23-6-5-16(12)13(18)10-4-3-9(17(20)21)7-11(10)15/h3-4,7,12H,2,5-6,8H2,1H3