ethyl (3E,5E)-3,5-bis[(2,4-dimethylphenyl)methylidene]-4-oxidanylidene-piperidine-1-carboxylate

Systemtic Name: ethyl (3E,5E)-3,5-bis[(2,4-dimethylphenyl)methylidene]-4-oxidanylidene-piperidine-1-carboxylate Openeye Name: ethyl (3E,5E)-3,5-bis[(2,4-dimethylphenyl)methylene]-4-oxo-piperidine-1-carboxylate CAS Name: (3E,5E)-3,5-bis[(2,4-dimethylphenyl)methylidene]-4-oxo-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3E,5E)-3,5-bis[(2,4-dimethylphenyl)methylidene]-4-oxopiperidine-1-carboxylate Traditional Name: (3E,5E)-3,5-bis(2,4-dimethylbenzylidene)-4-keto-piperidine-1-carboxylic acid ethyl ester Formula: C26H29NO3 MolecularWeight: 403.51336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC(=CC2=C(C=C(C=C2)C)C)C(=O)C(=CC3=C(C=C(C=C3)C)C)C1

Isomeric SMILES

CCOC(=O)N1C/C(=C\C2=C(C=C(C=C2)C)C)/C(=O)/C(=C/C3=C(C=C(C=C3)C)C)/C1

InChI

InChI=1S/C26H29NO3/c1-6-30-26(29)27-15-23(13-21-9-7-17(2)11-19(21)4)25(28)24(16-27)14-22-10-8-18(3)12-20(22)5/h7-14H,6,15-16H2,1-5H3/b23-13+,24-14+