O6-ethyl O9-methyl 12-cyclohexylindolo[2,1-a]isoquinoline-6,9-dicarboxylate

Systemtic Name: O6-ethyl O9-methyl 12-cyclohexylindolo[2,1-a]isoquinoline-6,9-dicarboxylate Openeye Name: O6-ethyl O9-methyl 12-cyclohexylindolo[2,1-a]isoquinoline-6,9-dicarboxylate CAS Name: 12-cyclohexylindolo[2,1-a]isoquinoline-6,9-dicarboxylic acid O6-ethyl ester O9-methyl ester IUPAC Name: 6-O-ethyl 9-O-methyl 12-cyclohexylindolo[2,1-a]isoquinoline-6,9-dicarboxylate Traditional Name: 12-cyclohexylindol[2,1-a]isoquinoline-6,9-dicarboxylic acid O6-ethyl ester O9-methyl ester Formula: C27H27NO4 MolecularWeight: 429.50758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=CC=CC=C2C3=C(C4=C(N13)C=C(C=C4)C(=O)OC)C5CCCCC5

Isomeric SMILES

CCOC(=O)C1=CC2=CC=CC=C2C3=C(C4=C(N13)C=C(C=C4)C(=O)OC)C5CCCCC5

InChI

InChI=1S/C27H27NO4/c1-3-32-27(30)23-15-18-11-7-8-12-20(18)25-24(17-9-5-4-6-10-17)21-14-13-19(26(29)31-2)16-22(21)28(23)25/h7-8,11-17H,3-6,9-10H2,1-2H3