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

Systemtic Name: butyl 2-[1-[3-(2-methylprop-2-enoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: butyl 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 butyl ester IUPAC Name: butyl 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 butyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O5/c1-4-5-11-27-19(24)13-18-20(25)22-9-10-23(18)21(26)16-7-6-8-17(12-16)28-14-15(2)3/h6-8,12,18H,2,4-5,9-11,13-14H2,1,3H3,(H,22,25)