[2-[(4-iodophenyl)amino]-2-oxidanylidene-ethyl] (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [2-[(4-iodophenyl)amino]-2-oxidanylidene-ethyl] (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: [2-(4-iodoanilino)-2-oxo-ethyl] (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid [2-(4-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-iodoanilino)-2-oxoethyl] (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid [2-(4-iodoanilino)-2-keto-ethyl] ester Formula: C20H15IN2O3 MolecularWeight: 458.24917

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C=CC(=O)OCC(=O)NC3=CC=C(C=C3)I)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)/C=C/C(=O)OCC(=O)NC3=CC=C(C=C3)I)N=CC=C2

InChI

InChI=1S/C20H15IN2O3/c21-16-7-9-17(10-8-16)23-18(24)13-26-19(25)11-6-15-4-1-3-14-5-2-12-22-20(14)15/h1-12H,13H2,(H,23,24)/b11-6+