ethyl 4-[3-chloranyl-4-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-chloranyl-4-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[3-chloro-4-(2-methoxy-2-oxo-ethoxy)phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[3-chloro-4-(2-methoxy-2-oxoethoxy)phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-chloro-4-(2-methoxy-2-oxoethoxy)phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[3-chloro-4-(2-keto-2-methoxy-ethoxy)phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C16H21ClN2O7S MolecularWeight: 420.86514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)OC)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)OC)Cl

InChI

InChI=1S/C16H21ClN2O7S/c1-3-25-16(21)18-6-8-19(9-7-18)27(22,23)12-4-5-14(13(17)10-12)26-11-15(20)24-2/h4-5,10H,3,6-9,11H2,1-2H3