ethyl 2-[1-[4-(3-methylbutoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[1-[4-(3-methylbutoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[1-(4-isopentyloxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[[4-(3-methylbutoxy)phenyl]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[4-(3-methylbutoxy)benzoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(4-isoamoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid ethyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O5/c1-4-26-18(23)13-17-19(24)21-10-11-22(17)20(25)15-5-7-16(8-6-15)27-12-9-14(2)3/h5-8,14,17H,4,9-13H2,1-3H3,(H,21,24)