phenethyl 2-[1-(2,4-diethoxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: phenethyl 2-[1-(2,4-diethoxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: phenethyl 2-[1-(2,4-diethoxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(2,4-diethoxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid phenethyl ester IUPAC Name: phenethyl 2-[1-(2,4-diethoxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(2,4-diethoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid phenethyl ester Formula: C25H30N2O6 MolecularWeight: 454.5155

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCCC3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCCC3=CC=CC=C3)OCC

InChI

InChI=1S/C25H30N2O6/c1-3-31-19-10-11-20(22(16-19)32-4-2)25(30)27-14-13-26-24(29)21(27)17-23(28)33-15-12-18-8-6-5-7-9-18/h5-11,16,21H,3-4,12-15,17H2,1-2H3,(H,26,29)