(E)-2-acetamido-3-[3,5-bis(bromanyl)-4-butoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-[3,5-bis(bromanyl)-4-butoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(3,5-dibromo-4-butoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(3,5-dibromo-4-butoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(3,5-dibromo-4-butoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(3,5-dibromo-4-butoxy-phenyl)acrylic acid Formula: C15H17Br2NO4 MolecularWeight: 435.10778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Br)C=C(C(=O)O)NC(=O)C)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Br)/C=C(\C(=O)O)/NC(=O)C)Br

InChI

InChI=1S/C15H17Br2NO4/c1-3-4-5-22-14-11(16)6-10(7-12(14)17)8-13(15(20)21)18-9(2)19/h6-8H,3-5H2,1-2H3,(H,18,19)(H,20,21)/b13-8+