lithium (E)-[1-(4-dodecoxy-2-methoxy-phenyl)-5-oxidanylidene-2-propyl-imidazol-4-ylidene]methanolate

Systemtic Name: lithium (E)-[1-(4-dodecoxy-2-methoxy-phenyl)-5-oxidanylidene-2-propyl-imidazol-4-ylidene]methanolate Openeye Name: lithium (E)-[1-(4-dodecoxy-2-methoxy-phenyl)-5-oxo-2-propyl-imidazol-4-ylidene]methanolate CAS Name: lithium (E)-[1-(4-dodecoxy-2-methoxyphenyl)-5-oxo-2-propyl-4-imidazolylidene]methanolate IUPAC Name: lithium (E)-[1-(4-dodecoxy-2-methoxyphenyl)-5-oxo-2-propylimidazol-4-ylidene]methanolate Traditional Name: lithium (E)-[5-keto-1-(4-lauryloxy-2-methoxy-phenyl)-2-propyl-2-imidazolin-4-ylidene]methanolate Formula: C26H39LiN2O4 MolecularWeight: 450.53986

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CCCCCCCCCCCCOC1=CC(=C(C=C1)N2C(=NC(=C[O-])C2=O)CCC)OC

Isomeric SMILES

[Li+].CCCCCCCCCCCCOC1=CC(=C(C=C1)N2C(=N/C(=C/[O-])/C2=O)CCC)OC

InChI

InChI=1S/C26H40N2O4.Li/c1-4-6-7-8-9-10-11-12-13-14-18-32-21-16-17-23(24(19-21)31-3)28-25(15-5-2)27-22(20-29)26(28)30;/h16-17,19-20,29H,4-15,18H2,1-3H3;/q;+1/p-1/b22-20+;