2-(1,3-benzodioxol-5-yl)-2-(2-propylphenoxy)ethanoic acid

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-(2-propylphenoxy)ethanoic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-(2-propylphenoxy)acetic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(2-propylphenoxy)acetic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-(2-propylphenoxy)acetic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(2-propylphenoxy)acetic acid Formula: C18H18O5 MolecularWeight: 314.33252

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1OC(C2=CC3=C(C=C2)OCO3)C(=O)O

Isomeric SMILES

CCCC1=CC=CC=C1OC(C2=CC3=C(C=C2)OCO3)C(=O)O

InChI

InChI=1S/C18H18O5/c1-2-5-12-6-3-4-7-14(12)23-17(18(19)20)13-8-9-15-16(10-13)22-11-21-15/h3-4,6-10,17H,2,5,11H2,1H3,(H,19,20)