5-(1-hydroxyethyl)-2-thiophen-2-yl-anthracene-9-carboxylic acid

Systemtic Name: 5-(1-hydroxyethyl)-2-thiophen-2-yl-anthracene-9-carboxylic acid Openeye Name: 5-(1-hydroxyethyl)-2-(2-thienyl)anthracene-9-carboxylic acid CAS Name: 5-(1-hydroxyethyl)-2-thiophen-2-yl-9-anthracenecarboxylic acid IUPAC Name: 5-(1-hydroxyethyl)-2-thiophen-2-ylanthracene-9-carboxylic acid Traditional Name: 5-(1-hydroxyethyl)-2-(2-thienyl)anthracene-9-carboxylic acid Formula: C21H16O3S MolecularWeight: 348.41494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=C1C=C3C=CC(=CC3=C2C(=O)O)C4=CC=CS4)O

Isomeric SMILES

CC(C1=CC=CC2=C1C=C3C=CC(=CC3=C2C(=O)O)C4=CC=CS4)O

InChI

InChI=1S/C21H16O3S/c1-12(22)15-4-2-5-16-18(15)10-13-7-8-14(19-6-3-9-25-19)11-17(13)20(16)21(23)24/h2-12,22H,1H3,(H,23,24)