(E)-2-acetamido-3-(3-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-(3-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(3-bromo-4-isopropoxy-5-methoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(3-bromo-4-isopropoxy-5-methoxy-phenyl)acrylic acid Formula: C15H18BrNO5 MolecularWeight: 372.21112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Br)C=C(C(=O)O)NC(=O)C)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Br)/C=C(\C(=O)O)/NC(=O)C)OC

InChI

InChI=1S/C15H18BrNO5/c1-8(2)22-14-11(16)5-10(7-13(14)21-4)6-12(15(19)20)17-9(3)18/h5-8H,1-4H3,(H,17,18)(H,19,20)/b12-6+