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4-[(2-butyl-6-oxidanylidene-pyridin-1-yl)methyl]benzoic acid

4-[(2-butyl-6-oxidanylidene-pyridin-1-yl)methyl]benzoic acid

Systemtic Name:4-[(2-butyl-6-oxidanylidene-pyridin-1-yl)methyl]benzoic acid
Openeye Name:4-[(2-butyl-6-oxo-1-pyridyl)methyl]benzoic acid
CAS Name:4-[(2-butyl-6-oxo-1-pyridinyl)methyl]benzoic acid
IUPAC Name:4-[(2-butyl-6-oxopyridin-1-yl)methyl]benzoic acid
Traditional Name:4-[(2-butyl-6-keto-1-pyridyl)methyl]benzoic acid
Formula: C17H19NO3
MolecularWeight: 285.33766
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC(=O)N1CC2=CC=C(C=C2)C(=O)O


Isomeric SMILES

CCCCC1=CC=CC(=O)N1CC2=CC=C(C=C2)C(=O)O


InChI

InChI=1S/C17H19NO3/c1-2-3-5-15-6-4-7-16(19)18(15)12-13-8-10-14(11-9-13)17(20)21/h4,6-11H,2-3,5,12H2,1H3,(H,20,21)


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