[1-oxidanylidene-1-(quinolin-5-ylamino)propan-2-yl] 1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxylate

Systemtic Name: [1-oxidanylidene-1-(quinolin-5-ylamino)propan-2-yl] 1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-(5-quinolylamino)ethyl] 2-benzyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-(phenylmethyl)-5-isoindolecarboxylic acid [1-oxo-1-(5-quinolinylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(quinolin-5-ylamino)propan-2-yl] 2-benzyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-benzyl-1,3-diketo-isoindoline-5-carboxylic acid [2-keto-1-methyl-2-(5-quinolylamino)ethyl] ester Formula: C28H21N3O5 MolecularWeight: 479.48344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)OC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CC=C5

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)OC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CC=C5

InChI

InChI=1S/C28H21N3O5/c1-17(25(32)30-24-11-5-10-23-21(24)9-6-14-29-23)36-28(35)19-12-13-20-22(15-19)27(34)31(26(20)33)16-18-7-3-2-4-8-18/h2-15,17H,16H2,1H3,(H,30,32)