ethanedioic acid; [2-[1-(triphenylmethyl)imidazol-4-yl]phenyl]methanamine

Systemtic Name: ethanedioic acid; [2-[1-(triphenylmethyl)imidazol-4-yl]phenyl]methanamine Openeye Name: oxalic acid; [2-(1-tritylimidazol-4-yl)phenyl]methanamine CAS Name: oxalic acid; [2-[1-(triphenylmethyl)-4-imidazolyl]phenyl]methanamine IUPAC Name: oxalic acid; [2-(1-tritylimidazol-4-yl)phenyl]methanamine Traditional Name: oxalic acid; [2-(1-tritylimidazol-4-yl)benzyl]amine Formula: C31H27N3O4 MolecularWeight: 505.56378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)C5=CC=CC=C5CN.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)C5=CC=CC=C5CN.C(=O)(C(=O)O)O

InChI

InChI=1S/C29H25N3.C2H2O4/c30-20-23-12-10-11-19-27(23)28-21-32(22-31-28)29(24-13-4-1-5-14-24,25-15-6-2-7-16-25)26-17-8-3-9-18-26;3-1(4)2(5)6/h1-19,21-22H,20,30H2;(H,3,4)(H,5,6)