ethyl 1,4-dimethyl-2-(2-oxidanylidenepropyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 1,4-dimethyl-2-(2-oxidanylidenepropyl)pyrrole-3-carboxylate Openeye Name: ethyl 2-acetonyl-1,4-dimethyl-pyrrole-3-carboxylate CAS Name: 1,4-dimethyl-2-(2-oxopropyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,4-dimethyl-2-(2-oxopropyl)pyrrole-3-carboxylate Traditional Name: 2-acetonyl-1,4-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C=C1C)C)CC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(N(C=C1C)C)CC(=O)C

InChI

InChI=1S/C12H17NO3/c1-5-16-12(15)11-8(2)7-13(4)10(11)6-9(3)14/h7H,5-6H2,1-4H3