3-[4-[3-(hydroxymethyl)phenyl]-2-methyl-phenoxy]-2-methyl-butanoate

Systemtic Name: 3-[4-[3-(hydroxymethyl)phenyl]-2-methyl-phenoxy]-2-methyl-butanoate Openeye Name: 3-[4-[3-(hydroxymethyl)phenyl]-2-methyl-phenoxy]-2-methyl-butanoate CAS Name: 3-[4-[3-(hydroxymethyl)phenyl]-2-methylphenoxy]-2-methylbutanoate IUPAC Name: 3-[4-[3-(hydroxymethyl)phenyl]-2-methylphenoxy]-2-methylbutanoate Traditional Name: 2-methyl-3-[2-methyl-4-(3-methylolphenyl)phenoxy]butyrate Formula: C19H21O4- MolecularWeight: 313.36764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=CC=C2)CO)OC(C)C(C)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=CC=C2)CO)OC(C)C(C)C(=O)[O-]

InChI

InChI=1S/C19H22O4/c1-12-9-17(16-6-4-5-15(10-16)11-20)7-8-18(12)23-14(3)13(2)19(21)22/h4-10,13-14,20H,11H2,1-3H3,(H,21,22)/p-1