ethyl 1-[5-chloranyl-2-(2,2-dimethylpropanoylamino)phenyl]sulfonylpyrrole-2-carboxylate

Systemtic Name: ethyl 1-[5-chloranyl-2-(2,2-dimethylpropanoylamino)phenyl]sulfonylpyrrole-2-carboxylate Openeye Name: ethyl 1-[5-chloro-2-(2,2-dimethylpropanoylamino)phenyl]sulfonylpyrrole-2-carboxylate CAS Name: 1-[5-chloro-2-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]sulfonyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-chloro-2-(2,2-dimethylpropanoylamino)phenyl]sulfonylpyrrole-2-carboxylate Traditional Name: 1-[5-chloro-2-(pivaloylamino)phenyl]sulfonylpyrrole-2-carboxylic acid ethyl ester Formula: C18H21ClN2O5S MolecularWeight: 412.88774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)NC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)NC(=O)C(C)(C)C

InChI

InChI=1S/C18H21ClN2O5S/c1-5-26-16(22)14-7-6-10-21(14)27(24,25)15-11-12(19)8-9-13(15)20-17(23)18(2,3)4/h6-11H,5H2,1-4H3,(H,20,23)