2-[4-[6-[(E)-2-piperidin-4-ylethenyl]-2H-indazol-3-yl]piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[6-[(E)-2-piperidin-4-ylethenyl]-2H-indazol-3-yl]piperidin-1-yl]ethanoic acid Openeye Name: 2-[4-[6-[(E)-2-(4-piperidyl)vinyl]-2H-indazol-3-yl]-1-piperidyl]acetic acid CAS Name: 2-[4-[6-[(E)-2-(4-piperidinyl)ethenyl]-2H-indazol-3-yl]-1-piperidinyl]acetic acid IUPAC Name: 2-[4-[6-[(E)-2-piperidin-4-ylethenyl]-2H-indazol-3-yl]piperidin-1-yl]acetic acid Traditional Name: 2-[4-[6-[(E)-2-(4-piperidyl)vinyl]-2H-indazol-3-yl]piperidino]acetic acid Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C=CC2=CC3=NNC(=C3C=C2)C4CCN(CC4)CC(=O)O

Isomeric SMILES

C1CNCCC1/C=C/C2=CC3=NNC(=C3C=C2)C4CCN(CC4)CC(=O)O

InChI

InChI=1S/C21H28N4O2/c26-20(27)14-25-11-7-17(8-12-25)21-18-4-3-16(13-19(18)23-24-21)2-1-15-5-9-22-10-6-15/h1-4,13,15,17,22H,5-12,14H2,(H,23,24)(H,26,27)/b2-1+