ethyl 6-methyl-3-(3-oxidanylidene-3-phenylmethoxy-propyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

Systemtic Name: ethyl 6-methyl-3-(3-oxidanylidene-3-phenylmethoxy-propyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate Openeye Name: ethyl 3-(3-benzyloxy-3-oxo-propyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate CAS Name: 6-methyl-3-(3-oxo-3-phenylmethoxypropyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-3-(3-oxo-3-phenylmethoxypropyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate Traditional Name: 3-(3-benzoxy-3-keto-propyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid ethyl ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(NC2=C(O1)C=CC(=C2)C)CCC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1C(NC2=C(O1)C=CC(=C2)C)CCC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H25NO5/c1-3-26-22(25)21-17(23-18-13-15(2)9-11-19(18)28-21)10-12-20(24)27-14-16-7-5-4-6-8-16/h4-9,11,13,17,21,23H,3,10,12,14H2,1-2H3