ethyl 8-cyano-1-ethoxy-9-phenylmethoxy-7,8-dihydro-6H-cyclopenta[g]isoquinoline-3-carboxylate

Systemtic Name: ethyl 8-cyano-1-ethoxy-9-phenylmethoxy-7,8-dihydro-6H-cyclopenta[g]isoquinoline-3-carboxylate Openeye Name: ethyl 9-benzyloxy-8-cyano-1-ethoxy-7,8-dihydro-6H-cyclopenta[g]isoquinoline-3-carboxylate CAS Name: 8-cyano-1-ethoxy-9-phenylmethoxy-7,8-dihydro-6H-cyclopenta[g]isoquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-cyano-1-ethoxy-9-phenylmethoxy-7,8-dihydro-6H-cyclopenta[g]isoquinoline-3-carboxylate Traditional Name: 9-benzoxy-8-cyano-1-ethoxy-7,8-dihydro-6H-cyclopent[g]isoquinoline-3-carboxylic acid ethyl ester Formula: C25H24N2O4 MolecularWeight: 416.46906

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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(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C25H24N2O4/c1-3-29-24-22-19(13-20(27-24)25(28)30-4-2)12-17-10-11-18(14-26)21(17)23(22)31-15-16-8-6-5-7-9-16/h5-9,12-13,18H,3-4,10-11,15H2,1-2H3