methyl 3-oxidanylidene-2-phenethyl-nonanoate

Systemtic Name: methyl 3-oxidanylidene-2-phenethyl-nonanoate Openeye Name: methyl 3-oxo-2-phenethyl-nonanoate CAS Name: 3-oxo-2-phenethylnonanoic acid methyl ester IUPAC Name: methyl 3-oxo-2-phenethylnonanoate Traditional Name: 3-keto-2-phenethyl-pelargonic acid methyl ester Formula: C18H26O3 MolecularWeight: 290.39724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C(CCC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCCCCCC(=O)C(CCC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C18H26O3/c1-3-4-5-9-12-17(19)16(18(20)21-2)14-13-15-10-7-6-8-11-15/h6-8,10-11,16H,3-5,9,12-14H2,1-2H3