2-[2,5-bis(oxidanylidene)-1-(2-phenoxyphenyl)pyrrolidin-3-yl]sulfanylbenzoic acid

Systemtic Name: 2-[2,5-bis(oxidanylidene)-1-(2-phenoxyphenyl)pyrrolidin-3-yl]sulfanylbenzoic acid Openeye Name: 2-[2,5-dioxo-1-(2-phenoxyphenyl)pyrrolidin-3-yl]sulfanylbenzoic acid CAS Name: 2-[[2,5-dioxo-1-(2-phenoxyphenyl)-3-pyrrolidinyl]thio]benzoic acid IUPAC Name: 2-[2,5-dioxo-1-(2-phenoxyphenyl)pyrrolidin-3-yl]sulfanylbenzoic acid Traditional Name: 2-[[2,5-diketo-1-(2-phenoxyphenyl)pyrrolidin-3-yl]thio]benzoic acid Formula: C23H17NO5S MolecularWeight: 419.44978

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=CC=C2OC3=CC=CC=C3)SC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=CC=C2OC3=CC=CC=C3)SC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C23H17NO5S/c25-21-14-20(30-19-13-7-4-10-16(19)23(27)28)22(26)24(21)17-11-5-6-12-18(17)29-15-8-2-1-3-9-15/h1-13,20H,14H2,(H,27,28)