ditert-butyl 5-ethenyl-1-oxidanylidene-4,5-dihydro-3H-azepino[3,4-b]indole-2,10-dicarboxylate

Systemtic Name: ditert-butyl 5-ethenyl-1-oxidanylidene-4,5-dihydro-3H-azepino[3,4-b]indole-2,10-dicarboxylate Openeye Name: ditert-butyl 1-oxo-5-vinyl-4,5-dihydro-3H-azepino[3,4-b]indole-2,10-dicarboxylate CAS Name: 5-ethenyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indole-2,10-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 5-ethenyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indole-2,10-dicarboxylate Traditional Name: 1-keto-5-vinyl-4,5-dihydro-3H-azepin[3,4-b]indole-2,10-dicarboxylic acid ditert-butyl ester Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C2=C(C1=O)N(C3=CC=CC=C32)C(=O)OC(C)(C)C)C=C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C2=C(C1=O)N(C3=CC=CC=C32)C(=O)OC(C)(C)C)C=C

InChI

InChI=1S/C24H30N2O5/c1-8-15-13-14-25(21(28)30-23(2,3)4)20(27)19-18(15)16-11-9-10-12-17(16)26(19)22(29)31-24(5,6)7/h8-12,15H,1,13-14H2,2-7H3