(E)-3-[4-bromanyl-2-(4-methylpiperazin-1-yl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-bromanyl-2-(4-methylpiperazin-1-yl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-bromo-2-(4-methylpiperazin-1-yl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-bromo-2-(4-methyl-1-piperazinyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-bromo-2-(4-methylpiperazin-1-yl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-bromo-2-(4-methylpiperazino)phenyl]acrylic acid Formula: C14H17BrN2O2 MolecularWeight: 325.20098

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC(=C2)Br)C=CC(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC(=C2)Br)/C=C/C(=O)O

InChI

InChI=1S/C14H17BrN2O2/c1-16-6-8-17(9-7-16)13-10-12(15)4-2-11(13)3-5-14(18)19/h2-5,10H,6-9H2,1H3,(H,18,19)/b5-3+