methyl 5-[4-(3-methoxy-3-oxidanylidene-propyl)phenyl]pentanoate

Systemtic Name: methyl 5-[4-(3-methoxy-3-oxidanylidene-propyl)phenyl]pentanoate Openeye Name: methyl 5-[4-(3-methoxy-3-oxo-propyl)phenyl]pentanoate CAS Name: 5-[4-(3-methoxy-3-oxopropyl)phenyl]pentanoic acid methyl ester IUPAC Name: methyl 5-[4-(3-methoxy-3-oxopropyl)phenyl]pentanoate Traditional Name: 5-[4-(3-keto-3-methoxy-propyl)phenyl]valeric acid methyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC1=CC=C(C=C1)CCC(=O)OC

Isomeric SMILES

COC(=O)CCCCC1=CC=C(C=C1)CCC(=O)OC

InChI

InChI=1S/C16H22O4/c1-19-15(17)6-4-3-5-13-7-9-14(10-8-13)11-12-16(18)20-2/h7-10H,3-6,11-12H2,1-2H3