ethyl (5E)-5-[[(4-cyclohexylphenyl)amino]methylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl (5E)-5-[[(4-cyclohexylphenyl)amino]methylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate Openeye Name: ethyl (5E)-5-[(4-cyclohexylanilino)methylene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate CAS Name: (5E)-5-[(4-cyclohexylanilino)methylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-[(4-cyclohexylanilino)methylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate Traditional Name: (5E)-5-[(4-cyclohexylanilino)methylene]-4-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=CNC2=CC=C(C=C2)C3CCCCC3)C1=O)C

Isomeric SMILES

CCOC(=O)C1=C(N/C(=C/NC2=CC=C(C=C2)C3CCCCC3)/C1=O)C

InChI

InChI=1S/C21H26N2O3/c1-3-26-21(25)19-14(2)23-18(20(19)24)13-22-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h9-13,15,22-23H,3-8H2,1-2H3/b18-13+