3-cyanopropyl (3E)-3-[(3,4-dimethoxyphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

Systemtic Name: 3-cyanopropyl (3E)-3-[(3,4-dimethoxyphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Openeye Name: 3-cyanopropyl (3E)-3-[(3,4-dimethoxyphenyl)methylene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate CAS Name: (3E)-3-[(3,4-dimethoxyphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl (3E)-3-[(3,4-dimethoxyphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Traditional Name: (3E)-3-veratrylidene-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid 3-cyanopropyl ester Formula: C26H24N2O4 MolecularWeight: 428.47976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2CCC3=C(C4=CC=CC=C4N=C23)C(=O)OCCCC#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/2\CCC3=C(C4=CC=CC=C4N=C23)C(=O)OCCCC#N)OC

InChI

InChI=1S/C26H24N2O4/c1-30-22-12-9-17(16-23(22)31-2)15-18-10-11-20-24(26(29)32-14-6-5-13-27)19-7-3-4-8-21(19)28-25(18)20/h3-4,7-9,12,15-16H,5-6,10-11,14H2,1-2H3/b18-15+