sodium (7-methylbenzo[a]anthracen-12-yl) sulfate

Systemtic Name: sodium (7-methylbenzo[a]anthracen-12-yl) sulfate Openeye Name: sodium (7-methylbenzo[a]anthracen-12-yl) sulfate CAS Name: sodium (7-methyl-12-benzo[a]anthracenyl) sulfate IUPAC Name: sodium (7-methylbenzo[a]anthracen-12-yl) sulfate Traditional Name: sodium (7-methylbenz[a]anthracen-12-yl) sulfate Formula: C19H13NaO4S MolecularWeight: 360.35889

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C14)OS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C14)OS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C19H14O4S.Na/c1-12-14-7-4-5-9-17(14)19(23-24(20,21)22)18-15(12)11-10-13-6-2-3-8-16(13)18;/h2-11H,1H3,(H,20,21,22);/q;+1/p-1