3-heptan-2-yloxy-3-oxidanylidene-2-phenyl-propanoate

Systemtic Name: 3-heptan-2-yloxy-3-oxidanylidene-2-phenyl-propanoate Openeye Name: 3-(1-methylhexoxy)-3-oxo-2-phenyl-propanoate CAS Name: 3-heptan-2-yloxy-3-oxo-2-phenylpropanoate IUPAC Name: 3-heptan-2-yloxy-3-oxo-2-phenylpropanoate Traditional Name: 3-keto-3-(1-methylhexoxy)-2-phenyl-propionate Formula: C16H21O4- MolecularWeight: 277.33554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)OC(=O)C(C1=CC=CC=C1)C(=O)[O-]

Isomeric SMILES

CCCCCC(C)OC(=O)C(C1=CC=CC=C1)C(=O)[O-]

InChI

InChI=1S/C16H22O4/c1-3-4-6-9-12(2)20-16(19)14(15(17)18)13-10-7-5-8-11-13/h5,7-8,10-12,14H,3-4,6,9H2,1-2H3,(H,17,18)/p-1