2-(7-oxidanylidenebenzo[a]phenalen-3-yl)sulfanylethanoic acid

Systemtic Name: 2-(7-oxidanylidenebenzo[a]phenalen-3-yl)sulfanylethanoic acid Openeye Name: 2-(7-oxobenzo[a]phenalen-3-yl)sulfanylacetic acid CAS Name: 2-[(7-oxo-3-benzo[a]phenalenyl)thio]acetic acid IUPAC Name: 2-(7-oxobenzo[a]phenalen-3-yl)sulfanylacetic acid Traditional Name: 2-[(7-ketobenzo[a]phenalen-3-yl)thio]acetic acid Formula: C19H12O3S MolecularWeight: 320.36178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C4C(=C(C=C3)SCC(=O)O)C=CC=C4C2=O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C4C(=C(C=C3)SCC(=O)O)C=CC=C4C2=O

InChI

InChI=1S/C19H12O3S/c20-17(21)10-23-16-9-8-12-11-4-1-2-5-13(11)19(22)15-7-3-6-14(16)18(12)15/h1-9H,10H2,(H,20,21)