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1-(2-ethylnonyl)-6-methyl-2-oxidanylidene-pyridine-3-carboxylic acid

1-(2-ethylnonyl)-6-methyl-2-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name:1-(2-ethylnonyl)-6-methyl-2-oxidanylidene-pyridine-3-carboxylic acid
Openeye Name:1-(2-ethylnonyl)-6-methyl-2-oxo-pyridine-3-carboxylic acid
CAS Name:1-(2-ethylnonyl)-6-methyl-2-oxo-3-pyridinecarboxylic acid
IUPAC Name:1-(2-ethylnonyl)-6-methyl-2-oxopyridine-3-carboxylic acid
Traditional Name:1-(2-ethylnonyl)-2-keto-6-methyl-nicotinic acid
Formula: C18H29NO3
MolecularWeight: 307.42776
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC)CN1C(=CC=C(C1=O)C(=O)O)C


Isomeric SMILES

CCCCCCCC(CC)CN1C(=CC=C(C1=O)C(=O)O)C


InChI

InChI=1S/C18H29NO3/c1-4-6-7-8-9-10-15(5-2)13-19-14(3)11-12-16(17(19)20)18(21)22/h11-12,15H,4-10,13H2,1-3H3,(H,21,22)


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