[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanoate

Systemtic Name: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanoate Openeye Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 4-(4-acetylpiperazin-1-yl)-4-oxo-butanoate CAS Name: 4-(4-acetyl-1-piperazinyl)-4-oxobutanoic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 4-(4-acetylpiperazin-1-yl)-4-oxobutanoate Traditional Name: 4-(4-acetylpiperazino)-4-keto-butyric acid (2-keto-2-mesidino-ethyl) ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)CCC(=O)N2CCN(CC2)C(=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)CCC(=O)N2CCN(CC2)C(=O)C)C

InChI

InChI=1S/C21H29N3O5/c1-14-11-15(2)21(16(3)12-14)22-18(26)13-29-20(28)6-5-19(27)24-9-7-23(8-10-24)17(4)25/h11-12H,5-10,13H2,1-4H3,(H,22,26)