3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)propanoate

Systemtic Name: 3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)propanoate Openeye Name: 3-(3-chloro-5-methoxy-4-propoxy-phenyl)propanoate CAS Name: 3-(3-chloro-5-methoxy-4-propoxyphenyl)propanoate IUPAC Name: 3-(3-chloro-5-methoxy-4-propoxyphenyl)propanoate Traditional Name: 3-(3-chloro-5-methoxy-4-propoxy-phenyl)propionate Formula: C13H16ClO4- MolecularWeight: 271.71674

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)CCC(=O)[O-])OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)CCC(=O)[O-])OC

InChI

InChI=1S/C13H17ClO4/c1-3-6-18-13-10(14)7-9(4-5-12(15)16)8-11(13)17-2/h7-8H,3-6H2,1-2H3,(H,15,16)/p-1