sodium 2,4,5,7-tetramethyl-9-(2-methylphenyl)-6-oxidanylidene-xanthen-3-olate

Systemtic Name: sodium 2,4,5,7-tetramethyl-9-(2-methylphenyl)-6-oxidanylidene-xanthen-3-olate Openeye Name: sodium 2,4,5,7-tetramethyl-9-(o-tolyl)-6-oxo-xanthen-3-olate CAS Name: sodium 2,4,5,7-tetramethyl-9-(2-methylphenyl)-6-oxo-3-xanthenolate IUPAC Name: sodium 2,4,5,7-tetramethyl-9-(2-methylphenyl)-6-oxoxanthen-3-olate Traditional Name: sodium 6-keto-2,4,5,7-tetramethyl-9-(o-tolyl)xanthen-3-olate Formula: C24H21NaO3 MolecularWeight: 380.41151

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C3C=C(C(=O)C(=C3OC4=C(C(=C(C=C24)C)[O-])C)C)C.[Na+]

Isomeric SMILES

CC1=CC=CC=C1C2=C3C=C(C(=O)C(=C3OC4=C(C(=C(C=C24)C)[O-])C)C)C.[Na+]

InChI

InChI=1S/C24H22O3.Na/c1-12-8-6-7-9-17(12)20-18-10-13(2)21(25)15(4)23(18)27-24-16(5)22(26)14(3)11-19(20)24;/h6-11,25H,1-5H3;/q;+1/p-1