2-(9H-thioxanthen-9-yl)propanedioate

Systemtic Name: 2-(9H-thioxanthen-9-yl)propanedioate Openeye Name: 2-(9H-thioxanthen-9-yl)propanedioate CAS Name: 2-(9H-thioxanthen-9-yl)propanedioate IUPAC Name: 2-(9H-thioxanthen-9-yl)propanedioate Traditional Name: 2-(9H-thioxanthen-9-yl)malonate Formula: C16H10O4S-2 MolecularWeight: 298.3132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3S2)C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3S2)C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C16H12O4S/c17-15(18)14(16(19)20)13-9-5-1-3-7-11(9)21-12-8-4-2-6-10(12)13/h1-8,13-14H,(H,17,18)(H,19,20)/p-2