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

Systemtic Name: ethyl 3-(3-oxidanylidene-3-phenylmethoxy-propyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate Openeye Name: ethyl 3-(3-benzyloxy-3-oxo-propyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate CAS Name: 3-(3-oxo-3-phenylmethoxypropyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-oxo-3-phenylmethoxypropyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate Traditional Name: 3-(3-benzoxy-3-keto-propyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid ethyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO5/c1-2-25-21(24)20-17(22-16-10-6-7-11-18(16)27-20)12-13-19(23)26-14-15-8-4-3-5-9-15/h3-11,17,20,22H,2,12-14H2,1H3