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

Systemtic Name: decyl 2-[1-[3-(2-methylprop-2-enoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: decyl 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 decyl ester IUPAC Name: decyl 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 decyl ester Formula: C27H40N2O5 MolecularWeight: 472.6169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H40N2O5/c1-4-5-6-7-8-9-10-11-17-33-25(30)19-24-26(31)28-15-16-29(24)27(32)22-13-12-14-23(18-22)34-20-21(2)3/h12-14,18,24H,2,4-11,15-17,19-20H2,1,3H3,(H,28,31)