4-chloranylbutyl 3,4,5-trimethoxybenzoate

Systemtic Name: 4-chloranylbutyl 3,4,5-trimethoxybenzoate Openeye Name: 4-chlorobutyl 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid 4-chlorobutyl ester IUPAC Name: 4-chlorobutyl 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid 4-chlorobutyl ester Formula: C14H19ClO5 MolecularWeight: 302.75066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCCCCCl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCCCCCl

InChI

InChI=1S/C14H19ClO5/c1-17-11-8-10(9-12(18-2)13(11)19-3)14(16)20-7-5-4-6-15/h8-9H,4-7H2,1-3H3