(E)-3-[3-(6-piperazin-1-ylpyrazin-2-yl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-(6-piperazin-1-ylpyrazin-2-yl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-(6-piperazin-1-ylpyrazin-2-yl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-[6-(1-piperazinyl)-2-pyrazinyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-(6-piperazin-1-ylpyrazin-2-yl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-(6-piperazinopyrazin-2-yl)phenyl]acrylic acid Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC(=CN=C2)C3=CC(=CC=C3)C=CC(=O)O

Isomeric SMILES

C1CN(CCN1)C2=NC(=CN=C2)C3=CC(=CC=C3)/C=C/C(=O)O

InChI

InChI=1S/C17H18N4O2/c22-17(23)5-4-13-2-1-3-14(10-13)15-11-19-12-16(20-15)21-8-6-18-7-9-21/h1-5,10-12,18H,6-9H2,(H,22,23)/b5-4+