3-pyridin-2-ylpropyl 3,4,5-trimethoxybenzoate

Systemtic Name: 3-pyridin-2-ylpropyl 3,4,5-trimethoxybenzoate Openeye Name: 3-(2-pyridyl)propyl 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid 3-(2-pyridinyl)propyl ester IUPAC Name: 3-pyridin-2-ylpropyl 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid 3-(2-pyridyl)propyl ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCCCC2=CC=CC=N2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCCCC2=CC=CC=N2

InChI

InChI=1S/C18H21NO5/c1-21-15-11-13(12-16(22-2)17(15)23-3)18(20)24-10-6-8-14-7-4-5-9-19-14/h4-5,7,9,11-12H,6,8,10H2,1-3H3