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

Systemtic Name: 2-[[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]amino]benzoic acid Openeye Name: 2-[[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]amino]benzoic acid CAS Name: 2-[[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]amino]benzoic acid Traditional Name: 2-[[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)acryloyl]amino]benzoic acid Formula: C18H15NO5 MolecularWeight: 325.3154

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C=CC(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)/C=C/C(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C18H15NO5/c20-17(19-14-4-2-1-3-13(14)18(21)22)8-6-12-5-7-15-16(11-12)24-10-9-23-15/h1-8,11H,9-10H2,(H,19,20)(H,21,22)/b8-6+