tert-butyl 6-bromanyl-1-oxidanylidene-3,4-dihydro-2H-pyrido[3,4-b]indole-9-carboxylate

Systemtic Name: tert-butyl 6-bromanyl-1-oxidanylidene-3,4-dihydro-2H-pyrido[3,4-b]indole-9-carboxylate Openeye Name: tert-butyl 6-bromo-1-oxo-3,4-dihydro-2H-pyrido[3,4-b]indole-9-carboxylate CAS Name: 6-bromo-1-oxo-3,4-dihydro-2H-pyrido[3,4-b]indole-9-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-bromo-1-oxo-3,4-dihydro-2H-pyrido[3,4-b]indole-9-carboxylate Traditional Name: 6-bromo-1-keto-3,4-dihydro-2H-$b-carboline-9-carboxylic acid tert-butyl ester Formula: C16H17BrN2O3 MolecularWeight: 365.22178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)Br)C3=C1C(=O)NCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)Br)C3=C1C(=O)NCC3

InChI

InChI=1S/C16H17BrN2O3/c1-16(2,3)22-15(21)19-12-5-4-9(17)8-11(12)10-6-7-18-14(20)13(10)19/h4-5,8H,6-7H2,1-3H3,(H,18,20)