ditert-butyl (5E)-5-ethylidene-1-oxidanylidene-3,4-dihydroazepino[3,4-b]indole-2,10-dicarboxylate

Systemtic Name: ditert-butyl (5E)-5-ethylidene-1-oxidanylidene-3,4-dihydroazepino[3,4-b]indole-2,10-dicarboxylate Openeye Name: ditert-butyl (5E)-5-ethylidene-1-oxo-3,4-dihydroazepino[3,4-b]indole-2,10-dicarboxylate CAS Name: (5E)-5-ethylidene-1-oxo-3,4-dihydroazepino[3,4-b]indole-2,10-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (5E)-5-ethylidene-1-oxo-3,4-dihydroazepino[3,4-b]indole-2,10-dicarboxylate Traditional Name: (5E)-5-ethylidene-1-keto-3,4-dihydroazepin[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=C1CCN(C(=O)C2=C1C3=CC=CC=C3N2C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

C/C=C/1\CCN(C(=O)C2=C1C3=CC=CC=C3N2C(=O)OC(C)(C)C)C(=O)OC(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/h8-12H,13-14H2,1-7H3/b15-8+