2,4-bis(oxidanylidene)-4-(4-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)butanoic acid

Systemtic Name: 2,4-bis(oxidanylidene)-4-(4-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)butanoic acid Openeye Name: 2,4-dioxo-4-(4-phenyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)butanoic acid CAS Name: 2,4-dioxo-4-(4-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)butanoic acid IUPAC Name: 2,4-dioxo-4-(4-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)butanoic acid Traditional Name: 2,4-diketo-4-(4-phenyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)butyric acid Formula: C18H16O4S MolecularWeight: 328.38224

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)SC(=C2)C(=O)CC(=O)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CC(C2=C(C1)SC(=C2)C(=O)CC(=O)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H16O4S/c19-14(10-15(20)18(21)22)17-9-13-12(7-4-8-16(13)23-17)11-5-2-1-3-6-11/h1-3,5-6,9,12H,4,7-8,10H2,(H,21,22)