3-methylbutyl 2-[3-oxidanylidene-1-[3-(2-phenoxyethoxy)phenyl]carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: 3-methylbutyl 2-[3-oxidanylidene-1-[3-(2-phenoxyethoxy)phenyl]carbonyl-piperazin-2-yl]ethanoate Openeye Name: isopentyl 2-[3-oxo-1-[3-(2-phenoxyethoxy)benzoyl]piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-[3-(2-phenoxyethoxy)phenyl]methyl]-2-piperazinyl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[3-oxo-1-[3-(2-phenoxyethoxy)benzoyl]piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[3-(2-phenoxyethoxy)benzoyl]piperazin-2-yl]acetic acid isoamyl ester Formula: C26H32N2O6 MolecularWeight: 468.54208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)OCCOC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C26H32N2O6/c1-19(2)11-14-34-24(29)18-23-25(30)27-12-13-28(23)26(31)20-7-6-10-22(17-20)33-16-15-32-21-8-4-3-5-9-21/h3-10,17,19,23H,11-16,18H2,1-2H3,(H,27,30)