methyl 4-[2-(hydroxymethyl)-7-methoxy-7-oxidanylidene-heptyl]benzoate

Systemtic Name: methyl 4-[2-(hydroxymethyl)-7-methoxy-7-oxidanylidene-heptyl]benzoate Openeye Name: methyl 4-[2-(hydroxymethyl)-7-methoxy-7-oxo-heptyl]benzoate CAS Name: 4-[2-(hydroxymethyl)-7-methoxy-7-oxoheptyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(hydroxymethyl)-7-methoxy-7-oxoheptyl]benzoate Traditional Name: 4-(7-keto-7-methoxy-2-methylol-heptyl)benzoic acid methyl ester Formula: C17H24O5 MolecularWeight: 308.36946

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC(CC1=CC=C(C=C1)C(=O)OC)CO

Isomeric SMILES

COC(=O)CCCCC(CC1=CC=C(C=C1)C(=O)OC)CO

InChI

InChI=1S/C17H24O5/c1-21-16(19)6-4-3-5-14(12-18)11-13-7-9-15(10-8-13)17(20)22-2/h7-10,14,18H,3-6,11-12H2,1-2H3