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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3

InChI

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