3-(2-ethyl-2-oxidanyl-butanoyl)-11H-benzo[b][1]benzazepine-5,6-dione

Systemtic Name: 3-(2-ethyl-2-oxidanyl-butanoyl)-11H-benzo[b][1]benzazepine-5,6-dione Openeye Name: 3-(2-ethyl-2-hydroxy-butanoyl)-11H-benzo[b][1]benzazepine-5,6-dione CAS Name: 3-(2-ethyl-2-hydroxy-1-oxobutyl)-11H-benzo[b][1]benzazepine-5,6-dione IUPAC Name: 3-(2-ethyl-2-hydroxybutanoyl)-11H-benzo[b][1]benzazepine-5,6-dione Traditional Name: 3-(2-ethyl-2-hydroxy-butanoyl)-11H-benzo[b][1]benzazepine-5,6-quinone Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)C1=CC2=C(C=C1)NC3=CC=CC=C3C(=O)C2=O)O

Isomeric SMILES

CCC(CC)(C(=O)C1=CC2=C(C=C1)NC3=CC=CC=C3C(=O)C2=O)O

InChI

InChI=1S/C20H19NO4/c1-3-20(25,4-2)19(24)12-9-10-16-14(11-12)18(23)17(22)13-7-5-6-8-15(13)21-16/h5-11,21,25H,3-4H2,1-2H3