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

Systemtic Name: (E)-3-[3-bromanyl-5-methoxy-4-(2-piperidin-1-ylethoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-bromo-5-methoxy-4-[2-(1-piperidyl)ethoxy]phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-bromo-5-methoxy-4-[2-(1-piperidinyl)ethoxy]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-bromo-5-methoxy-4-(2-piperidin-1-ylethoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-bromo-5-methoxy-4-(2-piperidinoethoxy)phenyl]acrylic acid Formula: C17H22BrNO4 MolecularWeight: 384.26488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)O)Br)OCCN2CCCCC2

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)O)Br)OCCN2CCCCC2

InChI

InChI=1S/C17H22BrNO4/c1-22-15-12-13(5-6-16(20)21)11-14(18)17(15)23-10-9-19-7-3-2-4-8-19/h5-6,11-12H,2-4,7-10H2,1H3,(H,20,21)/b6-5+