1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-9-phenylmethoxy-7,8-dihydro-6H-cyclopenta[g]isoquinoline-8-carbonitrile

Systemtic Name: 1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-9-phenylmethoxy-7,8-dihydro-6H-cyclopenta[g]isoquinoline-8-carbonitrile Openeye Name: 9-benzyloxy-1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-7,8-dihydro-6H-cyclopenta[g]isoquinoline-8-carbonitrile CAS Name: 1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-9-phenylmethoxy-7,8-dihydro-6H-cyclopenta[g]isoquinoline-8-carbonitrile IUPAC Name: 1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-9-phenylmethoxy-7,8-dihydro-6H-cyclopenta[g]isoquinoline-8-carbonitrile Traditional Name: 9-benzoxy-1-ethoxy-3-[(1E,3E)-penta-1,3-dienyl]-7,8-dihydro-6H-cyclopent[g]isoquinoline-8-carbonitrile Formula: C27H26N2O2 MolecularWeight: 410.50754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N2O2/c1-3-5-7-12-23-16-22-15-20-13-14-21(17-28)24(20)26(25(22)27(29-23)30-4-2)31-18-19-10-8-6-9-11-19/h3,5-12,15-16,21H,4,13-14,18H2,1-2H3/b5-3+,12-7+