2-[(3S)-2,5-bis(oxidanylidene)-1-(4-phenoxyphenyl)pyrrolidin-3-yl]sulfanylbenzoate

Systemtic Name: 2-[(3S)-2,5-bis(oxidanylidene)-1-(4-phenoxyphenyl)pyrrolidin-3-yl]sulfanylbenzoate Openeye Name: 2-[(3S)-2,5-dioxo-1-(4-phenoxyphenyl)pyrrolidin-3-yl]sulfanylbenzoate CAS Name: 2-[[(3S)-2,5-dioxo-1-(4-phenoxyphenyl)-3-pyrrolidinyl]thio]benzoate IUPAC Name: 2-[(3S)-2,5-dioxo-1-(4-phenoxyphenyl)pyrrolidin-3-yl]sulfanylbenzoate Traditional Name: 2-[[(3S)-2,5-diketo-1-(4-phenoxyphenyl)pyrrolidin-3-yl]thio]benzoate Formula: C23H16NO5S- MolecularWeight: 418.44184

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)OC3=CC=CC=C3)SC4=CC=CC=C4C(=O)[O-]

Isomeric SMILES

C1[C@@H](C(=O)N(C1=O)C2=CC=C(C=C2)OC3=CC=CC=C3)SC4=CC=CC=C4C(=O)[O-]

InChI

InChI=1S/C23H17NO5S/c25-21-14-20(30-19-9-5-4-8-18(19)23(27)28)22(26)24(21)15-10-12-17(13-11-15)29-16-6-2-1-3-7-16/h1-13,20H,14H2,(H,27,28)/p-1/t20-/m0/s1