3-chloranyl-5-methoxy-4-propoxy-benzoic acid

Systemtic Name: 3-chloranyl-5-methoxy-4-propoxy-benzoic acid Openeye Name: 3-chloro-5-methoxy-4-propoxy-benzoic acid CAS Name: 3-chloro-5-methoxy-4-propoxybenzoic acid IUPAC Name: 3-chloro-5-methoxy-4-propoxybenzoic acid Traditional Name: 3-chloro-5-methoxy-4-propoxy-benzoic acid Formula: C11H13ClO4 MolecularWeight: 244.67152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)O)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)O)OC

InChI

InChI=1S/C11H13ClO4/c1-3-4-16-10-8(12)5-7(11(13)14)6-9(10)15-2/h5-6H,3-4H2,1-2H3,(H,13,14)