(E)-3-[3-[6-(piperidin-4-ylmethylamino)pyrazin-2-yl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-[6-(piperidin-4-ylmethylamino)pyrazin-2-yl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-[6-(4-piperidylmethylamino)pyrazin-2-yl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-[6-(4-piperidinylmethylamino)-2-pyrazinyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-[6-(piperidin-4-ylmethylamino)pyrazin-2-yl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-[6-(4-piperidylmethylamino)pyrazin-2-yl]phenyl]acrylic acid Formula: C19H22N4O2 MolecularWeight: 338.40358

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CNC2=NC(=CN=C2)C3=CC(=CC=C3)C=CC(=O)O

Isomeric SMILES

C1CNCCC1CNC2=NC(=CN=C2)C3=CC(=CC=C3)/C=C/C(=O)O

InChI

InChI=1S/C19H22N4O2/c24-19(25)5-4-14-2-1-3-16(10-14)17-12-21-13-18(23-17)22-11-15-6-8-20-9-7-15/h1-5,10,12-13,15,20H,6-9,11H2,(H,22,23)(H,24,25)/b5-4+