2-[2-(2-decoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]carbonylbenzoic acid

Systemtic Name: 2-[2-(2-decoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]carbonylbenzoic acid Openeye Name: 2-[2-(2-decoxy-2-oxo-ethyl)-3-oxo-piperazine-1-carbonyl]benzoic acid CAS Name: 2-[[2-(2-decoxy-2-oxoethyl)-3-oxo-1-piperazinyl]-oxomethyl]benzoic acid IUPAC Name: 2-[2-(2-decoxy-2-oxoethyl)-3-oxopiperazine-1-carbonyl]benzoic acid Traditional Name: 2-[2-(2-decoxy-2-keto-ethyl)-3-keto-piperazine-1-carbonyl]benzoic acid Formula: C24H34N2O6 MolecularWeight: 446.53656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C24H34N2O6/c1-2-3-4-5-6-7-8-11-16-32-21(27)17-20-22(28)25-14-15-26(20)23(29)18-12-9-10-13-19(18)24(30)31/h9-10,12-13,20H,2-8,11,14-17H2,1H3,(H,25,28)(H,30,31)