(E)-3-(1,3-benzodioxol-5-yl)-2-[(4-fluorophenyl)carbonylamino]prop-2-enoate

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-[(4-fluorophenyl)carbonylamino]prop-2-enoate Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-[(4-fluorobenzoyl)amino]prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-[[(4-fluorophenyl)-oxomethyl]amino]-2-propenoate IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-[(4-fluorobenzoyl)amino]prop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-[(4-fluorobenzoyl)amino]acrylate Formula: C17H11FNO5- MolecularWeight: 328.271343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C(=O)[O-])/NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H12FNO5/c18-12-4-2-11(3-5-12)16(20)19-13(17(21)22)7-10-1-6-14-15(8-10)24-9-23-14/h1-8H,9H2,(H,19,20)(H,21,22)/p-1/b13-7+