2-[3-(1,3-benzodioxol-5-yl)propanoylamino]benzoate

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yl)propanoylamino]benzoate Openeye Name: 2-[3-(1,3-benzodioxol-5-yl)propanoylamino]benzoate CAS Name: 2-[[3-(1,3-benzodioxol-5-yl)-1-oxopropyl]amino]benzoate IUPAC Name: 2-[3-(1,3-benzodioxol-5-yl)propanoylamino]benzoate Traditional Name: 2-[3-(1,3-benzodioxol-5-yl)propanoylamino]benzoate Formula: C17H14NO5- MolecularWeight: 312.29676

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)NC3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)NC3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C17H15NO5/c19-16(18-13-4-2-1-3-12(13)17(20)21)8-6-11-5-7-14-15(9-11)23-10-22-14/h1-5,7,9H,6,8,10H2,(H,18,19)(H,20,21)/p-1