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

Systemtic Name: methyl 1-cyclohexyl-2-methyl-4-[(4-methylphenyl)methylidene]-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 1-cyclohexyl-2-methyl-5-oxo-4-(p-tolylmethylene)pyrrole-3-carboxylate CAS Name: 1-cyclohexyl-2-methyl-4-[(4-methylphenyl)methylidene]-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-cyclohexyl-2-methyl-4-[(4-methylphenyl)methylidene]-5-oxopyrrole-3-carboxylate Traditional Name: 1-cyclohexyl-5-keto-2-methyl-4-(4-methylbenzylidene)-2-pyrroline-3-carboxylic acid methyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=C(N(C2=O)C3CCCCC3)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C=C2C(=C(N(C2=O)C3CCCCC3)C)C(=O)OC

InChI

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