(diphenylmethyl) 2-[1,3-bis(oxidanylidene)isoindol-4-yl]oxy-2-thiophen-3-yl-ethanoate

Systemtic Name: (diphenylmethyl) 2-[1,3-bis(oxidanylidene)isoindol-4-yl]oxy-2-thiophen-3-yl-ethanoate Openeye Name: benzhydryl 2-(1,3-dioxoisoindolin-4-yl)oxy-2-(3-thienyl)acetate CAS Name: 2-[(1,3-dioxo-4-isoindolyl)oxy]-2-(3-thiophenyl)acetic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 2-(1,3-dioxoisoindol-4-yl)oxy-2-thiophen-3-ylacetate Traditional Name: 2-(1,3-diketoisoindolin-4-yl)oxy-2-(3-thienyl)acetic acid benzhydryl ester Formula: C27H19NO5S MolecularWeight: 469.50846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C(C3=CSC=C3)OC4=CC=CC5=C4C(=O)NC5=O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C(C3=CSC=C3)OC4=CC=CC5=C4C(=O)NC5=O

InChI

InChI=1S/C27H19NO5S/c29-25-20-12-7-13-21(22(20)26(30)28-25)32-24(19-14-15-34-16-19)27(31)33-23(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-16,23-24H,(H,28,29,30)