methyl 4-[2-(hydroxymethyl)-3,4-dihydro-2H-chromen-6-yl]benzoate

Systemtic Name: methyl 4-[2-(hydroxymethyl)-3,4-dihydro-2H-chromen-6-yl]benzoate Openeye Name: methyl 4-[2-(hydroxymethyl)chroman-6-yl]benzoate CAS Name: 4-[2-(hydroxymethyl)-3,4-dihydro-2H-1-benzopyran-6-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(hydroxymethyl)-3,4-dihydro-2H-chromen-6-yl]benzoate Traditional Name: 4-(2-methylolchroman-6-yl)benzoic acid methyl ester Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(CC3)CO

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(CC3)CO

InChI

InChI=1S/C18H18O4/c1-21-18(20)13-4-2-12(3-5-13)14-7-9-17-15(10-14)6-8-16(11-19)22-17/h2-5,7,9-10,16,19H,6,8,11H2,1H3