5-[4-(hydroxymethyl)-3-methoxy-phenoxy]pentanoate

Systemtic Name: 5-[4-(hydroxymethyl)-3-methoxy-phenoxy]pentanoate Openeye Name: 5-[4-(hydroxymethyl)-3-methoxy-phenoxy]pentanoate CAS Name: 5-[4-(hydroxymethyl)-3-methoxyphenoxy]pentanoate IUPAC Name: 5-[4-(hydroxymethyl)-3-methoxyphenoxy]pentanoate Traditional Name: 5-(3-methoxy-4-methylol-phenoxy)valerate Formula: C13H17O5- MolecularWeight: 253.27108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCCCCC(=O)[O-])CO

Isomeric SMILES

COC1=C(C=CC(=C1)OCCCCC(=O)[O-])CO

InChI

InChI=1S/C13H18O5/c1-17-12-8-11(6-5-10(12)9-14)18-7-3-2-4-13(15)16/h5-6,8,14H,2-4,7,9H2,1H3,(H,15,16)/p-1