ethyl 8-(1,3-benzodioxol-5-yl)-6-oxidanyl-9-oxidanylidene-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylate

Systemtic Name: ethyl 8-(1,3-benzodioxol-5-yl)-6-oxidanyl-9-oxidanylidene-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylate Openeye Name: ethyl 8-(1,3-benzodioxol-5-yl)-6-hydroxy-9-oxo-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylate CAS Name: 8-(1,3-benzodioxol-5-yl)-6-hydroxy-9-oxo-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylic acid ethyl ester IUPAC Name: ethyl 8-(1,3-benzodioxol-5-yl)-6-hydroxy-9-oxo-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylate Traditional Name: 8-(1,3-benzodioxol-5-yl)-6-hydroxy-9-keto-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylic acid ethyl ester Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12CC=CCC(C1=O)(N=C2C3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

CCOC(=O)C12CC=CCC(C1=O)(N=C2C3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C18H17NO6/c1-2-23-16(21)17-7-3-4-8-18(22,15(17)20)19-14(17)11-5-6-12-13(9-11)25-10-24-12/h3-6,9,22H,2,7-8,10H2,1H3