ditert-butyl 4-phenacyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate

Systemtic Name: ditert-butyl 4-phenacyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate Openeye Name: ditert-butyl 4-phenacyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate CAS Name: 4-phenacyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 4-phenacyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2,9-dicarboxylate Traditional Name: 4-phenacyl-3,4-dihydro-1H-$b-carboline-2,9-dicarboxylic acid ditert-butyl ester Formula: C29H34N2O5 MolecularWeight: 490.59066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C2=C(C1)N(C3=CC=CC=C32)C(=O)OC(C)(C)C)CC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(C2=C(C1)N(C3=CC=CC=C32)C(=O)OC(C)(C)C)CC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H34N2O5/c1-28(2,3)35-26(33)30-17-20(16-24(32)19-12-8-7-9-13-19)25-21-14-10-11-15-22(21)31(23(25)18-30)27(34)36-29(4,5)6/h7-15,20H,16-18H2,1-6H3