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

Systemtic Name: tert-butyl 1-(1-methoxy-3-methylsulfonyloxy-1-oxidanylidene-3-phenyl-propan-2-yl)-9-(phenylsulfonyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Openeye Name: tert-butyl 9-(benzenesulfonyl)-1-(1-methoxycarbonyl-2-methylsulfonyloxy-2-phenyl-ethyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate CAS Name: 9-(benzenesulfonyl)-1-(1-methoxy-3-methylsulfonyloxy-1-oxo-3-phenylpropan-2-yl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 9-(benzenesulfonyl)-1-(1-methoxy-3-methylsulfonyloxy-1-oxo-3-phenylpropan-2-yl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Traditional Name: 9-besyl-1-(1-carbomethoxy-2-methylsulfonyloxy-2-phenyl-ethyl)-3,4-dihydro-1H-$b-carboline-2-carboxylic acid tert-butyl ester Formula: C33H36N2O9S2 MolecularWeight: 668.77694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1C(C(C3=CC=CC=C3)OS(=O)(=O)C)C(=O)OC)N(C4=CC=CC=C24)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(C1C(C(C3=CC=CC=C3)OS(=O)(=O)C)C(=O)OC)N(C4=CC=CC=C24)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C33H36N2O9S2/c1-33(2,3)43-32(37)34-21-20-25-24-18-12-13-19-26(24)35(46(40,41)23-16-10-7-11-17-23)28(25)29(34)27(31(36)42-4)30(44-45(5,38)39)22-14-8-6-9-15-22/h6-19,27,29-30H,20-21H2,1-5H3