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

Systemtic Name: ethyl 4-[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(1,3-dioxo-2-phenethyl-isoindoline-5-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(1,3-dioxo-2-phenethyl-5-isoindolyl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-dioxo-2-phenethylisoindole-5-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(1,3-diketo-2-phenethyl-isoindoline-5-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C24H25N3O5 MolecularWeight: 435.4724

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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)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O5/c1-2-32-24(31)26-14-12-25(13-15-26)21(28)18-8-9-19-20(16-18)23(30)27(22(19)29)11-10-17-6-4-3-5-7-17/h3-9,16H,2,10-15H2,1H3