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

Systemtic Name: 2-(2H-indazol-3-yl)-3-phenyl-2-[2-[(E)-2-piperidin-4-ylethenyl]piperidin-1-yl]propanoic acid Openeye Name: 2-(2H-indazol-3-yl)-3-phenyl-2-[2-[(E)-2-(4-piperidyl)vinyl]-1-piperidyl]propanoic acid CAS Name: 2-(2H-indazol-3-yl)-3-phenyl-2-[2-[(E)-2-(4-piperidinyl)ethenyl]-1-piperidinyl]propanoic acid IUPAC Name: 2-(2H-indazol-3-yl)-3-phenyl-2-[2-[(E)-2-piperidin-4-ylethenyl]piperidin-1-yl]propanoic acid Traditional Name: 2-(2H-indazol-3-yl)-3-phenyl-2-[2-[(E)-2-(4-piperidyl)vinyl]piperidino]propionic acid Formula: C28H34N4O2 MolecularWeight: 458.59516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C=CC2CCNCC2)C(CC3=CC=CC=C3)(C4=C5C=CC=CC5=NN4)C(=O)O

Isomeric SMILES

C1CCN(C(C1)/C=C/C2CCNCC2)C(CC3=CC=CC=C3)(C4=C5C=CC=CC5=NN4)C(=O)O

InChI

InChI=1S/C28H34N4O2/c33-27(34)28(20-22-8-2-1-3-9-22,26-24-11-4-5-12-25(24)30-31-26)32-19-7-6-10-23(32)14-13-21-15-17-29-18-16-21/h1-5,8-9,11-14,21,23,29H,6-7,10,15-20H2,(H,30,31)(H,33,34)/b14-13+