2-[2-[2-(1,3-benzodioxol-5-yl)ethanoylamino]-5-chloranyl-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[2-(1,3-benzodioxol-5-yl)ethanoylamino]-5-chloranyl-phenoxy]ethanoic acid Openeye Name: 2-[2-[[2-(1,3-benzodioxol-5-yl)acetyl]amino]-5-chloro-phenoxy]acetic acid CAS Name: 2-[2-[[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]amino]-5-chlorophenoxy]acetic acid IUPAC Name: 2-[2-[[2-(1,3-benzodioxol-5-yl)acetyl]amino]-5-chlorophenoxy]acetic acid Traditional Name: 2-[2-[[2-(1,3-benzodioxol-5-yl)acetyl]amino]-5-chloro-phenoxy]acetic acid Formula: C17H14ClNO6 MolecularWeight: 363.74916

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC(=O)NC3=C(C=C(C=C3)Cl)OCC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC(=O)NC3=C(C=C(C=C3)Cl)OCC(=O)O

InChI

InChI=1S/C17H14ClNO6/c18-11-2-3-12(14(7-11)23-8-17(21)22)19-16(20)6-10-1-4-13-15(5-10)25-9-24-13/h1-5,7H,6,8-9H2,(H,19,20)(H,21,22)