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

Systemtic Name: 3-methylbutyl 2-[1-[3-(2-methylprop-2-enoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: isopentyl 2-[1-[3-(2-methylallyloxy)benzoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[[3-(2-methylprop-2-enoxy)phenyl]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[1-[3-(2-methylprop-2-enoxy)benzoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[3-(2-methylallyloxy)benzoyl]piperazin-2-yl]acetic acid isoamyl ester Formula: C22H30N2O5 MolecularWeight: 402.484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)OCC(=C)C

Isomeric SMILES

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)OCC(=C)C

InChI

InChI=1S/C22H30N2O5/c1-15(2)8-11-28-20(25)13-19-21(26)23-9-10-24(19)22(27)17-6-5-7-18(12-17)29-14-16(3)4/h5-7,12,15,19H,3,8-11,13-14H2,1-2,4H3,(H,23,26)