tert-butyl 6-methoxy-1-(1-methoxy-3-oxidanyl-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-oxidanyl-1-oxidanylidene-pent-4-en-2-yl)-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Openeye Name: tert-butyl 1-(2-hydroxy-1-methoxycarbonyl-but-3-enyl)-6-methoxy-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate CAS Name: 1-(3-hydroxy-1-methoxy-1-oxopent-4-en-2-yl)-6-methoxy-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(3-hydroxy-1-methoxy-1-oxopent-4-en-2-yl)-6-methoxy-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Traditional Name: 1-(1-carbomethoxy-2-hydroxy-but-3-enyl)-6-methoxy-9-methyl-3,4-dihydro-1H-$b-carboline-2-carboxylic acid tert-butyl ester Formula: C24H32N2O6 MolecularWeight: 444.52068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O6/c1-8-18(27)19(22(28)31-7)21-20-15(11-12-26(21)23(29)32-24(2,3)4)16-13-14(30-6)9-10-17(16)25(20)5/h8-10,13,18-19,21,27H,1,11-12H2,2-7H3