6-(2-oxidanylidene-3,4,5-triphenyl-imidazol-1-yl)hexanoate

Systemtic Name: 6-(2-oxidanylidene-3,4,5-triphenyl-imidazol-1-yl)hexanoate Openeye Name: 6-(2-oxo-3,4,5-triphenyl-imidazol-1-yl)hexanoate CAS Name: 6-(2-oxo-3,4,5-triphenyl-1-imidazolyl)hexanoate IUPAC Name: 6-(2-oxo-3,4,5-triphenylimidazol-1-yl)hexanoate Traditional Name: 6-(2-keto-3,4,5-triphenyl-4-imidazolin-1-yl)hexanoate Formula: C27H25N2O3- MolecularWeight: 425.499

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C(=O)N2CCCCCC(=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C(=O)N2CCCCCC(=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O3/c30-24(31)19-11-4-12-20-28-25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)29(27(28)32)23-17-9-3-10-18-23/h1-3,5-10,13-18H,4,11-12,19-20H2,(H,30,31)/p-1