4-[(6-ethanoyl-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]benzoate

Systemtic Name: 4-[(6-ethanoyl-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]benzoate Openeye Name: 4-[(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]benzoate CAS Name: 4-[(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]benzoate IUPAC Name: 4-[(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]benzoate Traditional Name: 4-[(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]benzoate Formula: C18H16NO4- MolecularWeight: 310.32394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCCN2CC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OCCN2CC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C18H17NO4/c1-12(20)15-6-7-17-16(10-15)19(8-9-23-17)11-13-2-4-14(5-3-13)18(21)22/h2-7,10H,8-9,11H2,1H3,(H,21,22)/p-1