tripotassium 2-(benzotriazol-2-yl)-6-hexan-2-yl-phenol phosphate

Systemtic Name: tripotassium 2-(benzotriazol-2-yl)-6-hexan-2-yl-phenol phosphate Openeye Name: tripotassium 2-(benzotriazol-2-yl)-6-(1-methylpentyl)phenol phosphate CAS Name: tripotassium 2-(2-benzotriazolyl)-6-hexan-2-ylphenol phosphate IUPAC Name: tripotassium 2-(benzotriazol-2-yl)-6-hexan-2-ylphenol phosphate Traditional Name: tripotassium 2-(benzotriazol-2-yl)-6-(1-methylpentyl)phenol phosphate Formula: C18H21K3N3O5P MolecularWeight: 507.645101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C1=C(C(=CC=C1)N2N=C3C=CC=CC3=N2)O.[O-]P(=O)([O-])[O-].[K+].[K+].[K+]

Isomeric SMILES

CCCCC(C)C1=C(C(=CC=C1)N2N=C3C=CC=CC3=N2)O.[O-]P(=O)([O-])[O-].[K+].[K+].[K+]

InChI

InChI=1S/C18H21N3O.3K.H3O4P/c1-3-4-8-13(2)14-9-7-12-17(18(14)22)21-19-15-10-5-6-11-16(15)20-21;;;;1-5(2,3)4/h5-7,9-13,22H,3-4,8H2,1-2H3;;;;(H3,1,2,3,4)/q;3*+1;/p-3