(E)-2-acetamido-3-(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(4-allyloxy-3-bromo-5-ethoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(4-allyloxy-3-bromo-5-ethoxy-phenyl)acrylic acid Formula: C16H18BrNO5 MolecularWeight: 384.22182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C(=O)O)NC(=O)C)Br)OCC=C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C(=O)O)/NC(=O)C)Br)OCC=C

InChI

InChI=1S/C16H18BrNO5/c1-4-6-23-15-12(17)7-11(9-14(15)22-5-2)8-13(16(20)21)18-10(3)19/h4,7-9H,1,5-6H2,2-3H3,(H,18,19)(H,20,21)/b13-8+