decyl 1,3-bis(oxidanylidene)-2-(4-phenoxyphenyl)isoindole-5-carboxylate

Systemtic Name: decyl 1,3-bis(oxidanylidene)-2-(4-phenoxyphenyl)isoindole-5-carboxylate Openeye Name: decyl 1,3-dioxo-2-(4-phenoxyphenyl)isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolecarboxylic acid decyl ester IUPAC Name: decyl 1,3-dioxo-2-(4-phenoxyphenyl)isoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(4-phenoxyphenyl)isoindoline-5-carboxylic acid decyl ester Formula: C31H33NO5 MolecularWeight: 499.59742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C31H33NO5/c1-2-3-4-5-6-7-8-12-21-36-31(35)23-15-20-27-28(22-23)30(34)32(29(27)33)24-16-18-26(19-17-24)37-25-13-10-9-11-14-25/h9-11,13-20,22H,2-8,12,21H2,1H3