methyl 1-butyl-4-methyl-5-methylidene-2-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl 1-butyl-4-methyl-5-methylidene-2-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 1-butyl-4-methyl-5-methylene-2-oxo-pyrrole-3-carboxylate CAS Name: 1-butyl-4-methyl-5-methylene-2-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-butyl-4-methyl-5-methylidene-2-oxopyrrole-3-carboxylate Traditional Name: 1-butyl-2-keto-4-methyl-5-methylene-3-pyrroline-3-carboxylic acid methyl ester Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C)C(=C(C1=O)C(=O)OC)C

Isomeric SMILES

CCCCN1C(=C)C(=C(C1=O)C(=O)OC)C

InChI

InChI=1S/C12H17NO3/c1-5-6-7-13-9(3)8(2)10(11(13)14)12(15)16-4/h3,5-7H2,1-2,4H3