5-[4-[2-(3-methylphenoxy)ethanoyl]piperazin-1-yl]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[4-[2-(3-methylphenoxy)ethanoyl]piperazin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: 5-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]-5-oxo-pentanoate CAS Name: 5-[4-[2-(3-methylphenoxy)-1-oxoethyl]-1-piperazinyl]-5-oxopentanoate IUPAC Name: 5-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]-5-oxopentanoate Traditional Name: 5-keto-5-[4-[2-(3-methylphenoxy)acetyl]piperazino]valerate Formula: C18H23N2O5- MolecularWeight: 347.38562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C(=O)CCCC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C(=O)CCCC(=O)[O-]

InChI

InChI=1S/C18H24N2O5/c1-14-4-2-5-15(12-14)25-13-17(22)20-10-8-19(9-11-20)16(21)6-3-7-18(23)24/h2,4-5,12H,3,6-11,13H2,1H3,(H,23,24)/p-1