2-oxidanylidenepropyl 2-(7-oxidanylidenebenzo[a]phenalen-3-yl)sulfanylethanoate

Systemtic Name: 2-oxidanylidenepropyl 2-(7-oxidanylidenebenzo[a]phenalen-3-yl)sulfanylethanoate Openeye Name: acetonyl 2-(7-oxobenzo[a]phenalen-3-yl)sulfanylacetate CAS Name: 2-[(7-oxo-3-benzo[a]phenalenyl)thio]acetic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 2-(7-oxobenzo[a]phenalen-3-yl)sulfanylacetate Traditional Name: 2-[(7-ketobenzo[a]phenalen-3-yl)thio]acetic acid acetonyl ester Formula: C22H16O4S MolecularWeight: 376.42504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)CSC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(=O)COC(=O)CSC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H16O4S/c1-13(23)11-26-20(24)12-27-19-10-9-15-14-5-2-3-6-16(14)22(25)18-8-4-7-17(19)21(15)18/h2-10H,11-12H2,1H3