2-(2-butyl-4-ethyl-2-phenyl-1,3-benzodioxol-5-yl)ethanoic acid

Systemtic Name: 2-(2-butyl-4-ethyl-2-phenyl-1,3-benzodioxol-5-yl)ethanoic acid Openeye Name: 2-(2-butyl-4-ethyl-2-phenyl-1,3-benzodioxol-5-yl)acetic acid CAS Name: 2-(2-butyl-4-ethyl-2-phenyl-1,3-benzodioxol-5-yl)acetic acid IUPAC Name: 2-(2-butyl-4-ethyl-2-phenyl-1,3-benzodioxol-5-yl)acetic acid Traditional Name: 2-(2-butyl-4-ethyl-2-phenyl-1,3-benzodioxol-5-yl)acetic acid Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(OC2=C(O1)C(=C(C=C2)CC(=O)O)CC)C3=CC=CC=C3

Isomeric SMILES

CCCCC1(OC2=C(O1)C(=C(C=C2)CC(=O)O)CC)C3=CC=CC=C3

InChI

InChI=1S/C21H24O4/c1-3-5-13-21(16-9-7-6-8-10-16)24-18-12-11-15(14-19(22)23)17(4-2)20(18)25-21/h6-12H,3-5,13-14H2,1-2H3,(H,22,23)