[4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]phenyl] 2-phenethylbenzoate

Systemtic Name: [4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]phenyl] 2-phenethylbenzoate Openeye Name: [4-[2-(1,3-dioxoisoindolin-2-yl)ethyl]phenyl] 2-phenethylbenzoate CAS Name: 2-phenethylbenzoic acid [4-[2-(1,3-dioxo-2-isoindolyl)ethyl]phenyl] ester IUPAC Name: [4-[2-(1,3-dioxoisoindol-2-yl)ethyl]phenyl] 2-phenethylbenzoate Traditional Name: 2-phenethylbenzoic acid [4-(2-phthalimidoethyl)phenyl] ester Formula: C31H25NO4 MolecularWeight: 475.5345

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=CC=C2C(=O)OC3=CC=C(C=C3)CCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=CC=C2C(=O)OC3=CC=C(C=C3)CCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C31H25NO4/c33-29-27-12-6-7-13-28(27)30(34)32(29)21-20-23-15-18-25(19-16-23)36-31(35)26-11-5-4-10-24(26)17-14-22-8-2-1-3-9-22/h1-13,15-16,18-19H,14,17,20-21H2