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

Systemtic Name: methyl 1-cyclohexyl-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 1-cyclohexyl-4-[(4-ethylphenyl)methylene]-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: 1-cyclohexyl-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-cyclohexyl-4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: 1-cyclohexyl-4-(4-ethylbenzylidene)-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=C2C(=C(N(C2=O)C3CCCCC3)C)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C=C2C(=C(N(C2=O)C3CCCCC3)C)C(=O)OC

InChI

InChI=1S/C22H27NO3/c1-4-16-10-12-17(13-11-16)14-19-20(22(25)26-3)15(2)23(21(19)24)18-8-6-5-7-9-18/h10-14,18H,4-9H2,1-3H3