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

Systemtic Name: methyl 3-[3-oxidanylidene-2-(2-oxidanylidene-2-pentoxy-ethyl)piperazin-1-yl]carbonylbenzoate Openeye Name: methyl 3-[3-oxo-2-(2-oxo-2-pentoxy-ethyl)piperazine-1-carbonyl]benzoate CAS Name: 3-[oxo-[3-oxo-2-(2-oxo-2-pentoxyethyl)-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[3-oxo-2-(2-oxo-2-pentoxyethyl)piperazine-1-carbonyl]benzoate Traditional Name: 3-[2-(2-amoxy-2-keto-ethyl)-3-keto-piperazine-1-carbonyl]benzoic acid methyl ester Formula: C20H26N2O6 MolecularWeight: 390.43024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O6/c1-3-4-5-11-28-17(23)13-16-18(24)21-9-10-22(16)19(25)14-7-6-8-15(12-14)20(26)27-2/h6-8,12,16H,3-5,9-11,13H2,1-2H3,(H,21,24)