(E)-3-(5-bromanyl-2-piperidin-1-yl-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(5-bromanyl-2-piperidin-1-yl-phenyl)prop-2-enoic acid Openeye Name: (E)-3-[5-bromo-2-(1-piperidyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[5-bromo-2-(1-piperidinyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-(5-bromo-2-piperidin-1-ylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(5-bromo-2-piperidino-phenyl)acrylic acid Formula: C14H16BrNO2 MolecularWeight: 310.18634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)Br)C=CC(=O)O

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)Br)/C=C/C(=O)O

InChI

InChI=1S/C14H16BrNO2/c15-12-5-6-13(16-8-2-1-3-9-16)11(10-12)4-7-14(17)18/h4-7,10H,1-3,8-9H2,(H,17,18)/b7-4+