tert-butyl (4R)-9-methyl-4-phenacyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate

Systemtic Name: tert-butyl (4R)-9-methyl-4-phenacyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Openeye Name: tert-butyl (4R)-9-methyl-4-phenacyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate CAS Name: (4R)-9-methyl-4-phenacyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4R)-9-methyl-4-phenacyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Traditional Name: (4R)-9-methyl-4-phenacyl-3,4-dihydro-1H-$b-carboline-2-carboxylic acid tert-butyl ester Formula: C25H28N2O3 MolecularWeight: 404.50142

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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)CC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H](C2=C(C1)N(C3=CC=CC=C32)C)CC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H28N2O3/c1-25(2,3)30-24(29)27-15-18(14-22(28)17-10-6-5-7-11-17)23-19-12-8-9-13-20(19)26(4)21(23)16-27/h5-13,18H,14-16H2,1-4H3/t18-/m0/s1