4-[[(E)-2-cyano-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]amino]benzoate

Systemtic Name: 4-[[(E)-2-cyano-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]amino]benzoate Openeye Name: 4-[[(E)-2-cyano-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 4-[[(E)-2-cyano-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-3-(2,3-dihydro-1,4-benzodioxin-6-yl)acryloyl]amino]benzoate Formula: C19H13N2O5- MolecularWeight: 349.31692

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C19H14N2O5/c20-11-14(9-12-1-6-16-17(10-12)26-8-7-25-16)18(22)21-15-4-2-13(3-5-15)19(23)24/h1-6,9-10H,7-8H2,(H,21,22)(H,23,24)/p-1/b14-9+