(4-pyrrolidin-1-ylcarbonylphenyl)methyl 4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]benzoate

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]benzoate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 4-[(1,3-dioxoisoindolin-2-yl)methyl]benzoate CAS Name: 4-[(1,3-dioxo-2-isoindolyl)methyl]benzoic acid [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 4-[(1,3-dioxoisoindol-2-yl)methyl]benzoate Traditional Name: 4-(phthalimidomethyl)benzoic acid [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C28H24N2O5 MolecularWeight: 468.50056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)COC(=O)C3=CC=C(C=C3)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)COC(=O)C3=CC=C(C=C3)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C28H24N2O5/c31-25(29-15-3-4-16-29)21-11-9-20(10-12-21)18-35-28(34)22-13-7-19(8-14-22)17-30-26(32)23-5-1-2-6-24(23)27(30)33/h1-2,5-14H,3-4,15-18H2