3-(1,3-benzodioxol-5-yl)-4-chloranyl-benzoate

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4-chloranyl-benzoate Openeye Name: 3-(1,3-benzodioxol-5-yl)-4-chloro-benzoate CAS Name: 3-(1,3-benzodioxol-5-yl)-4-chlorobenzoate IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4-chlorobenzoate Traditional Name: 3-(1,3-benzodioxol-5-yl)-4-chloro-benzoate Formula: C14H8ClO4- MolecularWeight: 275.66392

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(C=CC(=C3)C(=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(C=CC(=C3)C(=O)[O-])Cl

InChI

InChI=1S/C14H9ClO4/c15-11-3-1-9(14(16)17)5-10(11)8-2-4-12-13(6-8)19-7-18-12/h1-6H,7H2,(H,16,17)/p-1