2-phenoxyethyl 2-[1-(3-butan-2-yloxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 2-phenoxyethyl 2-[1-(3-butan-2-yloxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: 2-phenoxyethyl 2-[3-oxo-1-(3-sec-butoxybenzoyl)piperazin-2-yl]acetate CAS Name: 2-[1-[(3-butan-2-yloxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 2-[1-(3-butan-2-yloxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(3-sec-butoxybenzoyl)piperazin-2-yl]acetic acid 2-phenoxyethyl ester Formula: C25H30N2O6 MolecularWeight: 454.5155

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)C(=O)N2CCNC(=O)C2CC(=O)OCCOC3=CC=CC=C3

Isomeric SMILES

CCC(C)OC1=CC=CC(=C1)C(=O)N2CCNC(=O)C2CC(=O)OCCOC3=CC=CC=C3

InChI

InChI=1S/C25H30N2O6/c1-3-18(2)33-21-11-7-8-19(16-21)25(30)27-13-12-26-24(29)22(27)17-23(28)32-15-14-31-20-9-5-4-6-10-20/h4-11,16,18,22H,3,12-15,17H2,1-2H3,(H,26,29)