ethyl 6-chloranyl-7-methanoyl-4-(phenylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Systemtic Name: ethyl 6-chloranyl-7-methanoyl-4-(phenylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate Openeye Name: ethyl 4-benzyl-6-chloro-7-formyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate CAS Name: 6-chloro-7-formyl-4-(phenylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-benzyl-6-chloro-7-formyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate Traditional Name: 4-benzyl-6-chloro-7-formyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid ethyl ester Formula: C19H18ClNO4 MolecularWeight: 359.80352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(C2=C(O1)C=C(C(=C2)Cl)C=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CN(C2=C(O1)C=C(C(=C2)Cl)C=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H18ClNO4/c1-2-24-19(23)18-11-21(10-13-6-4-3-5-7-13)16-9-15(20)14(12-22)8-17(16)25-18/h3-9,12,18H,2,10-11H2,1H3