ethyl 2-oxidanyl-2-(1-oxidanylidene-3,10-dihydro-2H-azepino[3,4-b]indol-5-yl)ethanoate

Systemtic Name: ethyl 2-oxidanyl-2-(1-oxidanylidene-3,10-dihydro-2H-azepino[3,4-b]indol-5-yl)ethanoate Openeye Name: ethyl 2-hydroxy-2-(1-oxo-3,10-dihydro-2H-azepino[3,4-b]indol-5-yl)acetate CAS Name: 2-hydroxy-2-(1-oxo-3,10-dihydro-2H-azepino[3,4-b]indol-5-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-2-(1-oxo-3,10-dihydro-2H-azepino[3,4-b]indol-5-yl)acetate Traditional Name: 2-hydroxy-2-(1-keto-3,10-dihydro-2H-azepin[3,4-b]indol-5-yl)acetic acid ethyl ester Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CCNC(=O)C2=C1C3=CC=CC=C3N2)O

Isomeric SMILES

CCOC(=O)C(C1=CCNC(=O)C2=C1C3=CC=CC=C3N2)O

InChI

InChI=1S/C16H16N2O4/c1-2-22-16(21)14(19)10-7-8-17-15(20)13-12(10)9-5-3-4-6-11(9)18-13/h3-7,14,18-19H,2,8H2,1H3,(H,17,20)