methyl (2E)-2-[(4-nitrophenyl)methylidene]-5-phenyl-pent-4-ynoate

Systemtic Name: methyl (2E)-2-[(4-nitrophenyl)methylidene]-5-phenyl-pent-4-ynoate Openeye Name: methyl (2E)-2-[(4-nitrophenyl)methylene]-5-phenyl-pent-4-ynoate CAS Name: (2E)-2-[(4-nitrophenyl)methylidene]-5-phenyl-4-pentynoic acid methyl ester IUPAC Name: methyl (2E)-2-[(4-nitrophenyl)methylidene]-5-phenylpent-4-ynoate Traditional Name: (2E)-2-(4-nitrobenzylidene)-5-phenyl-pent-4-ynoic acid methyl ester Formula: C19H15NO4 MolecularWeight: 321.3267

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC=C(C=C1)[N+](=O)[O-])CC#CC2=CC=CC=C2

Isomeric SMILES

COC(=O)/C(=C/C1=CC=C(C=C1)[N+](=O)[O-])/CC#CC2=CC=CC=C2

InChI

InChI=1S/C19H15NO4/c1-24-19(21)17(9-5-8-15-6-3-2-4-7-15)14-16-10-12-18(13-11-16)20(22)23/h2-4,6-7,10-14H,9H2,1H3/b17-14+