8-(4,5-diphenylimidazol-1-yl)-2-ethyl-octanoate

Systemtic Name: 8-(4,5-diphenylimidazol-1-yl)-2-ethyl-octanoate Openeye Name: 8-(4,5-diphenylimidazol-1-yl)-2-ethyl-octanoate CAS Name: 8-(4,5-diphenyl-1-imidazolyl)-2-ethyloctanoate IUPAC Name: 8-(4,5-diphenylimidazol-1-yl)-2-ethyloctanoate Traditional Name: 8-(4,5-diphenylimidazol-1-yl)-2-ethyl-caprylate Formula: C25H29N2O2- MolecularWeight: 389.50996

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCCCCN1C=NC(=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CCC(CCCCCCN1C=NC(=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C25H30N2O2/c1-2-20(25(28)29)13-7-3-4-12-18-27-19-26-23(21-14-8-5-9-15-21)24(27)22-16-10-6-11-17-22/h5-6,8-11,14-17,19-20H,2-4,7,12-13,18H2,1H3,(H,28,29)/p-1