tert-butyl 6-methoxy-1-(1-methoxy-3-methylsulfonyloxy-1-oxidanylidene-pent-4-en-2-yl)-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate

Systemtic Name: tert-butyl 6-methoxy-1-(1-methoxy-3-methylsulfonyloxy-1-oxidanylidene-pent-4-en-2-yl)-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Openeye Name: tert-butyl 6-methoxy-1-(1-methoxycarbonyl-2-methylsulfonyloxy-but-3-enyl)-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate CAS Name: 6-methoxy-1-(1-methoxy-3-methylsulfonyloxy-1-oxopent-4-en-2-yl)-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-methoxy-1-(1-methoxy-3-methylsulfonyloxy-1-oxopent-4-en-2-yl)-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Traditional Name: 1-(1-carbomethoxy-2-methylsulfonyloxy-but-3-enyl)-6-methoxy-9-methyl-3,4-dihydro-1H-$b-carboline-2-carboxylic acid tert-butyl ester Formula: C25H34N2O8S MolecularWeight: 522.61106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1C(C(C=C)OS(=O)(=O)C)C(=O)OC)N(C3=C2C=C(C=C3)OC)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(C1C(C(C=C)OS(=O)(=O)C)C(=O)OC)N(C3=C2C=C(C=C3)OC)C

InChI

InChI=1S/C25H34N2O8S/c1-9-19(35-36(8,30)31)20(23(28)33-7)22-21-16(12-13-27(22)24(29)34-25(2,3)4)17-14-15(32-6)10-11-18(17)26(21)5/h9-11,14,19-20,22H,1,12-13H2,2-8H3