methyl 4-[3-oxidanylidene-2-[2-oxidanylidene-2-(3-phenylpropoxy)ethyl]piperazin-1-yl]carbonylbenzoate

Systemtic Name: methyl 4-[3-oxidanylidene-2-[2-oxidanylidene-2-(3-phenylpropoxy)ethyl]piperazin-1-yl]carbonylbenzoate Openeye Name: methyl 4-[3-oxo-2-[2-oxo-2-(3-phenylpropoxy)ethyl]piperazine-1-carbonyl]benzoate CAS Name: 4-[oxo-[3-oxo-2-[2-oxo-2-(3-phenylpropoxy)ethyl]-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-oxo-2-[2-oxo-2-(3-phenylpropoxy)ethyl]piperazine-1-carbonyl]benzoate Traditional Name: 4-[3-keto-2-[2-keto-2-(3-phenylpropoxy)ethyl]piperazine-1-carbonyl]benzoic acid methyl ester Formula: C24H26N2O6 MolecularWeight: 438.47304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C24H26N2O6/c1-31-24(30)19-11-9-18(10-12-19)23(29)26-14-13-25-22(28)20(26)16-21(27)32-15-5-8-17-6-3-2-4-7-17/h2-4,6-7,9-12,20H,5,8,13-16H2,1H3,(H,25,28)