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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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