methyl 4-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)butanoate

Systemtic Name: methyl 4-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)butanoate Openeye Name: methyl 4-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)butanoate CAS Name: 4-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)butanoic acid methyl ester IUPAC Name: methyl 4-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)butanoate Traditional Name: 4-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)butyric acid methyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1COC2=CC=CC=C2N1

Isomeric SMILES

COC(=O)CCCC1COC2=CC=CC=C2N1

InChI

InChI=1S/C13H17NO3/c1-16-13(15)8-4-5-10-9-17-12-7-3-2-6-11(12)14-10/h2-3,6-7,10,14H,4-5,8-9H2,1H3