(2-chloranyl-5-methyl-phenyl) 3-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: (2-chloranyl-5-methyl-phenyl) 3-(1,3-benzodioxol-5-yl)propanoate Openeye Name: (2-chloro-5-methyl-phenyl) 3-(1,3-benzodioxol-5-yl)propanoate CAS Name: 3-(1,3-benzodioxol-5-yl)propanoic acid (2-chloro-5-methylphenyl) ester IUPAC Name: (2-chloro-5-methylphenyl) 3-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 3-(1,3-benzodioxol-5-yl)propionic acid (2-chloro-5-methyl-phenyl) ester Formula: C17H15ClO4 MolecularWeight: 318.7516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC(=O)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC(=O)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H15ClO4/c1-11-2-5-13(18)15(8-11)22-17(19)7-4-12-3-6-14-16(9-12)21-10-20-14/h2-3,5-6,8-9H,4,7,10H2,1H3