(E)-3-[3-bromanyl-5-ethoxy-4-(2-piperidin-1-ylethoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-bromanyl-5-ethoxy-4-(2-piperidin-1-ylethoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-bromo-5-ethoxy-4-[2-(1-piperidyl)ethoxy]phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-bromo-5-ethoxy-4-[2-(1-piperidinyl)ethoxy]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-bromo-5-ethoxy-4-(2-piperidin-1-ylethoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-bromo-5-ethoxy-4-(2-piperidinoethoxy)phenyl]acrylic acid Formula: C18H24BrNO4 MolecularWeight: 398.29146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)O)Br)OCCN2CCCCC2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)O)Br)OCCN2CCCCC2

InChI

InChI=1S/C18H24BrNO4/c1-2-23-16-13-14(6-7-17(21)22)12-15(19)18(16)24-11-10-20-8-4-3-5-9-20/h6-7,12-13H,2-5,8-11H2,1H3,(H,21,22)/b7-6+