methyl 3-[2-(2-butan-2-yloxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]carbonylbenzoate

Systemtic Name: methyl 3-[2-(2-butan-2-yloxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]carbonylbenzoate Openeye Name: methyl 3-[3-oxo-2-(2-oxo-2-sec-butoxy-ethyl)piperazine-1-carbonyl]benzoate CAS Name: 3-[[2-(2-butan-2-yloxy-2-oxoethyl)-3-oxo-1-piperazinyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(2-butan-2-yloxy-2-oxoethyl)-3-oxopiperazine-1-carbonyl]benzoate Traditional Name: 3-[3-keto-2-(2-keto-2-sec-butoxy-ethyl)piperazine-1-carbonyl]benzoic acid methyl ester Formula: C19H24N2O6 MolecularWeight: 376.40366

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)C(=O)OC

Isomeric SMILES

CCC(C)OC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)C(=O)OC

InChI

InChI=1S/C19H24N2O6/c1-4-12(2)27-16(22)11-15-17(23)20-8-9-21(15)18(24)13-6-5-7-14(10-13)19(25)26-3/h5-7,10,12,15H,4,8-9,11H2,1-3H3,(H,20,23)