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

Systemtic Name: O9-tert-butyl O2-methyl 1-(4-oxidanylidenebutyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate Openeye Name: O9-tert-butyl O2-methyl 1-(4-oxobutyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate CAS Name: 1-(4-oxobutyl)-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-oxobutyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate Traditional Name: 1-(4-ketobutyl)-3,4-dihydro-1H-$b-carboline-2,9-dicarboxylic acid O9-tert-butyl ester O2-methyl ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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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)CCCC=O

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O5/c1-22(2,3)29-21(27)24-17-10-6-5-9-15(17)16-12-13-23(20(26)28-4)18(19(16)24)11-7-8-14-25/h5-6,9-10,14,18H,7-8,11-13H2,1-4H3