ethyl 4-[1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindol-5-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindol-5-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(2-benzyl-1,3-dioxo-isoindoline-5-carbonyl)piperazine-1-carboxylate CAS Name: 4-[[1,3-dioxo-2-(phenylmethyl)-5-isoindolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-benzyl-1,3-dioxoisoindole-5-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(2-benzyl-1,3-diketo-isoindoline-5-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H23N3O5/c1-2-31-23(30)25-12-10-24(11-13-25)20(27)17-8-9-18-19(14-17)22(29)26(21(18)28)15-16-6-4-3-5-7-16/h3-9,14H,2,10-13,15H2,1H3