ethyl 3-(4-oxidanylidene-4-phenylmethoxy-butanoyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

Systemtic Name: ethyl 3-(4-oxidanylidene-4-phenylmethoxy-butanoyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate Openeye Name: ethyl 3-(4-benzyloxy-4-oxo-butanoyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate CAS Name: 3-(1,4-dioxo-4-phenylmethoxybutyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-oxo-4-phenylmethoxybutanoyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate Traditional Name: 3-(4-benzoxy-4-keto-butanoyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid ethyl ester Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(NC2=CC=CC=C2O1)C(=O)CCC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1C(NC2=CC=CC=C2O1)C(=O)CCC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H23NO6/c1-2-27-22(26)21-20(23-16-10-6-7-11-18(16)29-21)17(24)12-13-19(25)28-14-15-8-4-3-5-9-15/h3-11,20-21,23H,2,12-14H2,1H3