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3,4,7-trimethyl-2-oxidanylidene-6-(piperidin-1-ium-1-ylmethyl)chromen-5-olate

3,4,7-trimethyl-2-oxidanylidene-6-(piperidin-1-ium-1-ylmethyl)chromen-5-olate

Systemtic Name:3,4,7-trimethyl-2-oxidanylidene-6-(piperidin-1-ium-1-ylmethyl)chromen-5-olate
Openeye Name:3,4,7-trimethyl-2-oxo-6-(piperidin-1-ium-1-ylmethyl)chromen-5-olate
CAS Name:3,4,7-trimethyl-2-oxo-6-(1-piperidin-1-iumylmethyl)-1-benzopyran-5-olate
IUPAC Name:3,4,7-trimethyl-2-oxo-6-(piperidin-1-ium-1-ylmethyl)chromen-5-olate
Traditional Name:2-keto-3,4,7-trimethyl-6-(piperidin-1-ium-1-ylmethyl)chromen-5-olate
Formula: C18H23NO3
MolecularWeight: 301.38012
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1C[NH+]3CCCCC3)[O-]


Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1C[NH+]3CCCCC3)[O-]


InChI

InChI=1S/C18H23NO3/c1-11-9-15-16(12(2)13(3)18(21)22-15)17(20)14(11)10-19-7-5-4-6-8-19/h9,20H,4-8,10H2,1-3H3


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