lithium (E)-[2-methyl-1-(3-nonadecoxyphenyl)-5-oxidanylidene-imidazol-4-ylidene]methanolate

Systemtic Name: lithium (E)-[2-methyl-1-(3-nonadecoxyphenyl)-5-oxidanylidene-imidazol-4-ylidene]methanolate Openeye Name: lithium (E)-[2-methyl-1-(3-nonadecoxyphenyl)-5-oxo-imidazol-4-ylidene]methanolate CAS Name: lithium (E)-[2-methyl-1-(3-nonadecoxyphenyl)-5-oxo-4-imidazolylidene]methanolate IUPAC Name: lithium (E)-[2-methyl-1-(3-nonadecoxyphenyl)-5-oxoimidazol-4-ylidene]methanolate Traditional Name: lithium (E)-[5-keto-2-methyl-1-(3-nonadecoxyphenyl)-2-imidazolin-4-ylidene]methanolate Formula: C30H47LiN2O3 MolecularWeight: 490.64678

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CCCCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)N2C(=NC(=C[O-])C2=O)C

Isomeric SMILES

[Li+].CCCCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)N2C(=N/C(=C/[O-])/C2=O)C

InChI

InChI=1S/C30H48N2O3.Li/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-35-28-22-20-21-27(24-28)32-26(2)31-29(25-33)30(32)34;/h20-22,24-25,33H,3-19,23H2,1-2H3;/q;+1/p-1/b29-25+;