2-[(triphenylmethyl)amino]-3-[1-(triphenylmethyl)imidazol-4-yl]propanoic acid

Systemtic Name: 2-[(triphenylmethyl)amino]-3-[1-(triphenylmethyl)imidazol-4-yl]propanoic acid Openeye Name: 2-(tritylamino)-3-(1-tritylimidazol-4-yl)propanoic acid CAS Name: 2-[(triphenylmethyl)amino]-3-[1-(triphenylmethyl)-4-imidazolyl]propanoic acid IUPAC Name: 2-(tritylamino)-3-(1-tritylimidazol-4-yl)propanoic acid Traditional Name: 2-(tritylamino)-3-(1-tritylimidazol-4-yl)propionic acid Formula: C44H37N3O2 MolecularWeight: 639.78348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(CC4=CN(C=N4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(CC4=CN(C=N4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)O

InChI

InChI=1S/C44H37N3O2/c48-42(49)41(46-43(34-19-7-1-8-20-34,35-21-9-2-10-22-35)36-23-11-3-12-24-36)31-40-32-47(33-45-40)44(37-25-13-4-14-26-37,38-27-15-5-16-28-38)39-29-17-6-18-30-39/h1-30,32-33,41,46H,31H2,(H,48,49)