[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 4-chloranyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: [1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 4-chloranyl-1-methyl-pyrrole-2-carboxylate Openeye Name: [2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 4-chloro-1-methyl-pyrrole-2-carboxylate CAS Name: 4-chloro-1-methyl-2-pyrrolecarboxylic acid [1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-1-oxopropan-2-yl] 4-chloro-1-methylpyrrole-2-carboxylate Traditional Name: 4-chloro-1-methyl-pyrrole-2-carboxylic acid [2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C13H19ClN2O3 MolecularWeight: 286.75456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)C1=CC(=CN1C)Cl

Isomeric SMILES

CC(C(=O)NC(C)(C)C)OC(=O)C1=CC(=CN1C)Cl

InChI

InChI=1S/C13H19ClN2O3/c1-8(11(17)15-13(2,3)4)19-12(18)10-6-9(14)7-16(10)5/h6-8H,1-5H3,(H,15,17)