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

Systemtic Name: 3-[4-[2-(3-methylphenoxy)ethanoyl]piperazin-1-yl]-3-oxidanylidene-propanoate Openeye Name: 3-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]-3-oxo-propanoate CAS Name: 3-[4-[2-(3-methylphenoxy)-1-oxoethyl]-1-piperazinyl]-3-oxopropanoate IUPAC Name: 3-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]-3-oxopropanoate Traditional Name: 3-keto-3-[4-[2-(3-methylphenoxy)acetyl]piperazino]propionate Formula: C16H19N2O5- MolecularWeight: 319.33246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O5/c1-12-3-2-4-13(9-12)23-11-15(20)18-7-5-17(6-8-18)14(19)10-16(21)22/h2-4,9H,5-8,10-11H2,1H3,(H,21,22)/p-1