[2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]oxyphenyl]phosphonic acid

Systemtic Name: [2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]oxyphenyl]phosphonic acid Openeye Name: [2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]oxyphenyl]phosphonic acid CAS Name: [2-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enoxy]phenyl]phosphonic acid IUPAC Name: [2-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]oxyphenyl]phosphonic acid Traditional Name: [2-[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]oxyphenyl]phosphonic acid Formula: C16H13O7P MolecularWeight: 348.243981

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC(=O)OC3=CC=CC=C3P(=O)(O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)OC3=CC=CC=C3P(=O)(O)O

InChI

InChI=1S/C16H13O7P/c17-16(23-13-3-1-2-4-15(13)24(18,19)20)8-6-11-5-7-12-14(9-11)22-10-21-12/h1-9H,10H2,(H2,18,19,20)/b8-6+