ethanoyl 2-[4-(2-oxidanylidene-4-piperidin-4-yl-piperazin-1-yl)phenoxy]butanoate

Systemtic Name: ethanoyl 2-[4-(2-oxidanylidene-4-piperidin-4-yl-piperazin-1-yl)phenoxy]butanoate Openeye Name: acetyl 2-[4-[2-oxo-4-(4-piperidyl)piperazin-1-yl]phenoxy]butanoate CAS Name: 2-[4-[2-oxo-4-(4-piperidinyl)-1-piperazinyl]phenoxy]butanoic acid acetyl ester IUPAC Name: acetyl 2-[4-(2-oxo-4-piperidin-4-ylpiperazin-1-yl)phenoxy]butanoate Traditional Name: 2-[4-[2-keto-4-(4-piperidyl)piperazino]phenoxy]butyric acid acetyl ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC(=O)C)OC1=CC=C(C=C1)N2CCN(CC2=O)C3CCNCC3

Isomeric SMILES

CCC(C(=O)OC(=O)C)OC1=CC=C(C=C1)N2CCN(CC2=O)C3CCNCC3

InChI

InChI=1S/C21H29N3O5/c1-3-19(21(27)28-15(2)25)29-18-6-4-17(5-7-18)24-13-12-23(14-20(24)26)16-8-10-22-11-9-16/h4-7,16,19,22H,3,8-14H2,1-2H3