ethyl 6-ethoxy-9-oxidanylidene-8-phenyl-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylate

Systemtic Name: ethyl 6-ethoxy-9-oxidanylidene-8-phenyl-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylate Openeye Name: ethyl 6-ethoxy-9-oxo-8-phenyl-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylate CAS Name: 6-ethoxy-9-oxo-8-phenyl-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylic acid ethyl ester IUPAC Name: ethyl 6-ethoxy-9-oxo-8-phenyl-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylate Traditional Name: 6-ethoxy-9-keto-8-phenyl-7-azabicyclo[4.2.1]nona-3,7-diene-1-carboxylic acid ethyl ester Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12CC=CCC(C1=O)(N=C2C3=CC=CC=C3)OCC

Isomeric SMILES

CCOC(=O)C12CC=CCC(C1=O)(N=C2C3=CC=CC=C3)OCC

InChI

InChI=1S/C19H21NO4/c1-3-23-17(22)18-12-8-9-13-19(16(18)21,24-4-2)20-15(18)14-10-6-5-7-11-14/h5-11H,3-4,12-13H2,1-2H3