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

Systemtic Name: methyl 1-cyclopentyl-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 1-cyclopentyl-4-[(4-ethylphenyl)methylene]-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: 1-cyclopentyl-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-cyclopentyl-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: 1-cyclopentyl-4-(4-ethylbenzylidene)-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=C2C(=C(N(C2=O)C3CCCC3)C)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C=C2C(=C(N(C2=O)C3CCCC3)C)C(=O)OC

InChI

InChI=1S/C21H25NO3/c1-4-15-9-11-16(12-10-15)13-18-19(21(24)25-3)14(2)22(20(18)23)17-7-5-6-8-17/h9-13,17H,4-8H2,1-3H3