ethyl 3-ethylperoxy-2-oxidanyl-2-(12-oxidanylidene-6H-indolo[2,1-b]quinazolin-6-yl)propanoate

Systemtic Name: ethyl 3-ethylperoxy-2-oxidanyl-2-(12-oxidanylidene-6H-indolo[2,1-b]quinazolin-6-yl)propanoate Openeye Name: ethyl 3-ethylperoxy-2-hydroxy-2-(12-oxo-6H-indolo[2,1-b]quinazolin-6-yl)propanoate CAS Name: 3-ethyldioxy-2-hydroxy-2-(12-oxo-6H-indolo[2,1-b]quinazolin-6-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-ethylperoxy-2-hydroxy-2-(12-oxo-6H-indolo[2,1-b]quinazolin-6-yl)propanoate Traditional Name: 3-ethylperoxy-2-hydroxy-2-(12-keto-6H-indolo[2,1-b]quinazolin-6-yl)propionic acid ethyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(COOCC)(C1C2=CC=CC=C2N3C1=NC4=CC=CC=C4C3=O)O

Isomeric SMILES

CCOC(=O)C(COOCC)(C1C2=CC=CC=C2N3C1=NC4=CC=CC=C4C3=O)O

InChI

InChI=1S/C22H22N2O6/c1-3-28-21(26)22(27,13-30-29-4-2)18-15-10-6-8-12-17(15)24-19(18)23-16-11-7-5-9-14(16)20(24)25/h5-12,18,27H,3-4,13H2,1-2H3