methyl 2-[3-chloranyl-4-(2-oxidanylidenepropoxy)phenyl]ethanoate

Systemtic Name: methyl 2-[3-chloranyl-4-(2-oxidanylidenepropoxy)phenyl]ethanoate Openeye Name: methyl 2-(4-acetonyloxy-3-chloro-phenyl)acetate CAS Name: 2-[3-chloro-4-(2-oxopropoxy)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-chloro-4-(2-oxopropoxy)phenyl]acetate Traditional Name: 2-(4-acetonyloxy-3-chloro-phenyl)acetic acid methyl ester Formula: C12H13ClO4 MolecularWeight: 256.68222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=C(C=C(C=C1)CC(=O)OC)Cl

Isomeric SMILES

CC(=O)COC1=C(C=C(C=C1)CC(=O)OC)Cl

InChI

InChI=1S/C12H13ClO4/c1-8(14)7-17-11-4-3-9(5-10(11)13)6-12(15)16-2/h3-5H,6-7H2,1-2H3