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

Systemtic Name: pentyl 2-[1-[3-(2-methylprop-2-enoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: pentyl 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 pentyl ester IUPAC Name: pentyl 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 amyl ester Formula: C22H30N2O5 MolecularWeight: 402.484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O5/c1-4-5-6-12-28-20(25)14-19-21(26)23-10-11-24(19)22(27)17-8-7-9-18(13-17)29-15-16(2)3/h7-9,13,19H,2,4-6,10-12,14-15H2,1,3H3,(H,23,26)