1-ethylpyrrolidine; 2-(3-methoxy-2-phenethyloxy-phenoxy)-2-oxidanylidene-ethanoate

Systemtic Name: 1-ethylpyrrolidine; 2-(3-methoxy-2-phenethyloxy-phenoxy)-2-oxidanylidene-ethanoate Openeye Name: 1-ethylpyrrolidine; 2-(3-methoxy-2-phenethyloxy-phenoxy)-2-oxo-acetate CAS Name: 1-ethylpyrrolidine; 2-(3-methoxy-2-phenethyloxyphenoxy)-2-oxoacetate IUPAC Name: 1-ethylpyrrolidine; 2-(3-methoxy-2-phenethyloxyphenoxy)-2-oxoacetate Traditional Name: 1-ethylpyrrolidine; 2-keto-2-(3-methoxy-2-phenethyloxy-phenoxy)acetate Formula: C23H28NO6- MolecularWeight: 414.47152

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1.COC1=CC=CC(=C1OCCC2=CC=CC=C2)OC(=O)C(=O)[O-]

Isomeric SMILES

CCN1CCCC1.COC1=CC=CC(=C1OCCC2=CC=CC=C2)OC(=O)C(=O)[O-]

InChI

InChI=1S/C17H16O6.C6H13N/c1-21-13-8-5-9-14(23-17(20)16(18)19)15(13)22-11-10-12-6-3-2-4-7-12;1-2-7-5-3-4-6-7/h2-9H,10-11H2,1H3,(H,18,19);2-6H2,1H3/p-1