sodium (E)-3-[1-(triphenylmethyl)imidazol-4-yl]prop-2-en-1-olate

Systemtic Name: sodium (E)-3-[1-(triphenylmethyl)imidazol-4-yl]prop-2-en-1-olate Openeye Name: sodium (E)-3-(1-tritylimidazol-4-yl)prop-2-en-1-olate CAS Name: sodium (E)-3-[1-(triphenylmethyl)-4-imidazolyl]-2-propen-1-olate IUPAC Name: sodium (E)-3-(1-tritylimidazol-4-yl)prop-2-en-1-olate Traditional Name: sodium (E)-3-(1-tritylimidazol-4-yl)prop-2-en-1-olate Formula: C25H21N2NaO MolecularWeight: 388.43681

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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)C=CC[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)/C=C/C[O-].[Na+]

InChI

InChI=1S/C25H21N2O.Na/c28-18-10-17-24-19-27(20-26-24)25(21-11-4-1-5-12-21,22-13-6-2-7-14-22)23-15-8-3-9-16-23;/h1-17,19-20H,18H2;/q-1;+1/b17-10+;