1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-9-phenylmethoxy-6,7-dihydrocyclopenta[g]isoquinolin-8-one

Systemtic Name: 1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-9-phenylmethoxy-6,7-dihydrocyclopenta[g]isoquinolin-8-one Openeye Name: 9-benzyloxy-1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-6,7-dihydrocyclopenta[g]isoquinolin-8-one CAS Name: 1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-9-phenylmethoxy-6,7-dihydrocyclopenta[g]isoquinolin-8-one IUPAC Name: 1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-9-phenylmethoxy-6,7-dihydrocyclopenta[g]isoquinolin-8-one Traditional Name: 9-benzoxy-1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-6,7-dihydrocyclopent[g]isoquinolin-8-one Formula: C26H25NO3 MolecularWeight: 399.4816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=CC2=CC3=C(C(=O)CC3)C(=C21)OCC4=CC=CC=C4)C=CC=CC

Isomeric SMILES

CCOC1=NC(=CC2=CC3=C(C(=O)CC3)C(=C21)OCC4=CC=CC=C4)/C=C/C=C/C

InChI

InChI=1S/C26H25NO3/c1-3-5-7-12-21-16-20-15-19-13-14-22(28)23(19)25(24(20)26(27-21)29-4-2)30-17-18-10-8-6-9-11-18/h3,5-12,15-16H,4,13-14,17H2,1-2H3/b5-3+,12-7+