tert-butyl 1-(1-methoxy-3-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate

Systemtic Name: tert-butyl 1-(1-methoxy-3-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Openeye Name: tert-butyl 1-[1-[hydroxy(phenyl)methyl]-2-methoxy-2-oxo-ethyl]-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate CAS Name: 1-(1-hydroxy-3-methoxy-3-oxo-1-phenylpropan-2-yl)-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(1-hydroxy-3-methoxy-3-oxo-1-phenylpropan-2-yl)-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Traditional Name: 1-(1-carbomethoxy-2-hydroxy-2-phenyl-ethyl)-9-methyl-3,4-dihydro-1H-$b-carboline-2-carboxylic acid tert-butyl ester Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1C(C(C3=CC=CC=C3)O)C(=O)OC)N(C4=CC=CC=C24)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(C1C(C(C3=CC=CC=C3)O)C(=O)OC)N(C4=CC=CC=C24)C

InChI

InChI=1S/C27H32N2O5/c1-27(2,3)34-26(32)29-16-15-19-18-13-9-10-14-20(18)28(4)22(19)23(29)21(25(31)33-5)24(30)17-11-7-6-8-12-17/h6-14,21,23-24,30H,15-16H2,1-5H3