methyl (5E)-5-butan-2-ylidene-2-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl (5E)-5-butan-2-ylidene-2-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl (5E)-5-(1-methylpropylidene)-2-oxo-pyrrole-3-carboxylate CAS Name: (5E)-5-butan-2-ylidene-2-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (5E)-5-butan-2-ylidene-2-oxopyrrole-3-carboxylate Traditional Name: (5E)-2-keto-5-(1-methylpropylidene)-3-pyrroline-3-carboxylic acid methyl ester Formula: C10H13NO3 MolecularWeight: 195.21512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C=C(C(=O)N1)C(=O)OC)C

Isomeric SMILES

CC/C(=C/1\C=C(C(=O)N1)C(=O)OC)/C

InChI

InChI=1S/C10H13NO3/c1-4-6(2)8-5-7(9(12)11-8)10(13)14-3/h5H,4H2,1-3H3,(H,11,12)/b8-6+