sodium (4-butan-2-ylphenyl)-phenyl-methanolate

Systemtic Name: sodium (4-butan-2-ylphenyl)-phenyl-methanolate Openeye Name: sodium phenyl-(4-sec-butylphenyl)methanolate CAS Name: sodium (4-butan-2-ylphenyl)-phenylmethanolate IUPAC Name: sodium (4-butan-2-ylphenyl)-phenylmethanolate Traditional Name: sodium phenyl-(4-sec-butylphenyl)methanolate Formula: C17H19NaO MolecularWeight: 262.32193

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)[O-].[Na+]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)[O-].[Na+]

InChI

InChI=1S/C17H19O.Na/c1-3-13(2)14-9-11-16(12-10-14)17(18)15-7-5-4-6-8-15;/h4-13,17H,3H2,1-2H3;/q-1;+1