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(1-oxidanyl-4-pyridin-3-yl-butan-2-yl) benzoate

(1-oxidanyl-4-pyridin-3-yl-butan-2-yl) benzoate

Systemtic Name:(1-oxidanyl-4-pyridin-3-yl-butan-2-yl) benzoate
Openeye Name:[1-(hydroxymethyl)-3-(3-pyridyl)propyl] benzoate
CAS Name:benzoic acid [1-hydroxy-4-(3-pyridinyl)butan-2-yl] ester
IUPAC Name:(1-hydroxy-4-pyridin-3-ylbutan-2-yl) benzoate
Traditional Name:benzoic acid [1-methylol-3-(3-pyridyl)propyl] ester
Formula: C16H17NO3
MolecularWeight: 271.31108
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(CCC2=CN=CC=C2)CO


Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC(CCC2=CN=CC=C2)CO


InChI

InChI=1S/C16H17NO3/c18-12-15(9-8-13-5-4-10-17-11-13)20-16(19)14-6-2-1-3-7-14/h1-7,10-11,15,18H,8-9,12H2


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