methyl 4-[[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(6-chloro-3-keto-1,4-benzoxazin-4-yl)acetyl]amino]methyl]benzoic acid methyl ester Formula: C19H17ClN2O5 MolecularWeight: 388.80168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C19H17ClN2O5/c1-26-19(25)13-4-2-12(3-5-13)9-21-17(23)10-22-15-8-14(20)6-7-16(15)27-11-18(22)24/h2-8H,9-11H2,1H3,(H,21,23)