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

Systemtic Name: prop-2-enyl (E)-3-(1,3-benzodioxol-5-yl)-2-[(2-iodanylphenyl)carbonylamino]prop-2-enoate Openeye Name: allyl (E)-3-(1,3-benzodioxol-5-yl)-2-[(2-iodobenzoyl)amino]prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-[[(2-iodophenyl)-oxomethyl]amino]-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-3-(1,3-benzodioxol-5-yl)-2-[(2-iodobenzoyl)amino]prop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-[(2-iodobenzoyl)amino]acrylic acid allyl ester Formula: C20H16INO5 MolecularWeight: 477.24921

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(=CC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

C=CCOC(=O)/C(=C\C1=CC2=C(C=C1)OCO2)/NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C20H16INO5/c1-2-9-25-20(24)16(22-19(23)14-5-3-4-6-15(14)21)10-13-7-8-17-18(11-13)27-12-26-17/h2-8,10-11H,1,9,12H2,(H,22,23)/b16-10+