methyl (4Z)-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxidanylidene-1-(oxolan-2-ylmethyl)pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxidanylidene-1-(oxolan-2-ylmethyl)pyrrole-3-carboxylate Openeye Name: methyl (4Z)-4-[(4-ethylphenyl)methylene]-2-methyl-5-oxo-1-(tetrahydrofuran-2-ylmethyl)pyrrole-3-carboxylate CAS Name: (4Z)-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxo-1-(2-oxolanylmethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxo-1-(oxolan-2-ylmethyl)pyrrole-3-carboxylate Traditional Name: (4Z)-4-(4-ethylbenzylidene)-5-keto-2-methyl-1-(tetrahydrofurfuryl)-2-pyrroline-3-carboxylic acid methyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=C2C(=C(N(C2=O)CC3CCCO3)C)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C\2/C(=C(N(C2=O)CC3CCCO3)C)C(=O)OC

InChI

InChI=1S/C21H25NO4/c1-4-15-7-9-16(10-8-15)12-18-19(21(24)25-3)14(2)22(20(18)23)13-17-6-5-11-26-17/h7-10,12,17H,4-6,11,13H2,1-3H3/b18-12-