2-[5-(3-ethoxyphenyl)-2-oxidanylidene-cyclohexyl]propanoate

Systemtic Name: 2-[5-(3-ethoxyphenyl)-2-oxidanylidene-cyclohexyl]propanoate Openeye Name: 2-[5-(3-ethoxyphenyl)-2-oxo-cyclohexyl]propanoate CAS Name: 2-[5-(3-ethoxyphenyl)-2-oxocyclohexyl]propanoate IUPAC Name: 2-[5-(3-ethoxyphenyl)-2-oxocyclohexyl]propanoate Traditional Name: 2-(2-keto-5-m-phenetyl-cyclohexyl)propionate Formula: C17H21O4- MolecularWeight: 289.34624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2CCC(=O)C(C2)C(C)C(=O)[O-]

Isomeric SMILES

CCOC1=CC=CC(=C1)C2CCC(=O)C(C2)C(C)C(=O)[O-]

InChI

InChI=1S/C17H22O4/c1-3-21-14-6-4-5-12(9-14)13-7-8-16(18)15(10-13)11(2)17(19)20/h4-6,9,11,13,15H,3,7-8,10H2,1-2H3,(H,19,20)/p-1