pentyl 2-[3-oxidanylidene-1-(4-propoxyphenyl)carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: pentyl 2-[3-oxidanylidene-1-(4-propoxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: pentyl 2-[3-oxo-1-(4-propoxybenzoyl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-(4-propoxyphenyl)methyl]-2-piperazinyl]acetic acid pentyl ester IUPAC Name: pentyl 2-[3-oxo-1-(4-propoxybenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(4-propoxybenzoyl)piperazin-2-yl]acetic acid amyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O5/c1-3-5-6-14-28-19(24)15-18-20(25)22-11-12-23(18)21(26)16-7-9-17(10-8-16)27-13-4-2/h7-10,18H,3-6,11-15H2,1-2H3,(H,22,25)