(E)-2-acetamido-3-[4-[(2-bromophenyl)methoxy]-3-ethoxy-5-iodanyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-[4-[(2-bromophenyl)methoxy]-3-ethoxy-5-iodanyl-phenyl]prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-[4-[(2-bromophenyl)methoxy]-3-ethoxy-5-iodo-phenyl]prop-2-enoic acid CAS Name: (E)-2-acetamido-3-[4-[(2-bromophenyl)methoxy]-3-ethoxy-5-iodophenyl]-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-[4-[(2-bromophenyl)methoxy]-3-ethoxy-5-iodophenyl]prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-[4-(2-bromobenzyl)oxy-3-ethoxy-5-iodo-phenyl]acrylic acid Formula: C20H19BrINO5 MolecularWeight: 560.17703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C(=O)O)NC(=O)C)I)OCC2=CC=CC=C2Br

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C(=O)O)/NC(=O)C)I)OCC2=CC=CC=C2Br

InChI

InChI=1S/C20H19BrINO5/c1-3-27-18-10-13(9-17(20(25)26)23-12(2)24)8-16(22)19(18)28-11-14-6-4-5-7-15(14)21/h4-10H,3,11H2,1-2H3,(H,23,24)(H,25,26)/b17-9+