ethyl 4-[(3S)-1-(4-acetyloxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(3S)-1-(4-acetyloxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(3S)-1-(4-acetoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]piperazine-1-carboxylate CAS Name: 4-[(3S)-1-(4-acetyloxyphenyl)-2,5-dioxo-3-pyrrolidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3S)-1-(4-acetyloxyphenyl)-2,5-dioxopyrrolidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[(3S)-1-(4-acetoxyphenyl)-2,5-diketo-pyrrolidin-3-yl]piperazine-1-carboxylic acid ethyl ester Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2CC(=O)N(C2=O)C3=CC=C(C=C3)OC(=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)[C@H]2CC(=O)N(C2=O)C3=CC=C(C=C3)OC(=O)C

InChI

InChI=1S/C19H23N3O6/c1-3-27-19(26)21-10-8-20(9-11-21)16-12-17(24)22(18(16)25)14-4-6-15(7-5-14)28-13(2)23/h4-7,16H,3,8-12H2,1-2H3/t16-/m0/s1