O9-tert-butyl O2-methyl 1-(4-phenylmethoxybutyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate

Systemtic Name: O9-tert-butyl O2-methyl 1-(4-phenylmethoxybutyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate Openeye Name: O9-tert-butyl O2-methyl 1-(4-benzyloxybutyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate CAS Name: 1-(4-phenylmethoxybutyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylic acid O9-tert-butyl ester O2-methyl ester IUPAC Name: 9-O-tert-butyl 2-O-methyl 1-(4-phenylmethoxybutyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate Traditional Name: 1-(4-benzoxybutyl)-3,4-dihydro-1H-$b-carboline-2,9-dicarboxylic acid O9-tert-butyl ester O2-methyl ester Formula: C29H36N2O5 MolecularWeight: 492.60654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=CC=CC=C2C3=C1C(N(CC3)C(=O)OC)CCCCOCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=CC=CC=C2C3=C1C(N(CC3)C(=O)OC)CCCCOCC4=CC=CC=C4

InChI

InChI=1S/C29H36N2O5/c1-29(2,3)36-28(33)31-24-15-9-8-14-22(24)23-17-18-30(27(32)34-4)25(26(23)31)16-10-11-19-35-20-21-12-6-5-7-13-21/h5-9,12-15,25H,10-11,16-20H2,1-4H3