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(3,4-diethoxyphenyl)-[(3S)-piperidin-1-ium-3-yl]methanone

(3,4-diethoxyphenyl)-[(3S)-piperidin-1-ium-3-yl]methanone

Systemtic Name:(3,4-diethoxyphenyl)-[(3S)-piperidin-1-ium-3-yl]methanone
Openeye Name:(3,4-diethoxyphenyl)-[(3S)-piperidin-1-ium-3-yl]methanone
CAS Name:(3,4-diethoxyphenyl)-[(3S)-3-piperidin-1-iumyl]methanone
IUPAC Name:(3,4-diethoxyphenyl)-[(3S)-piperidin-1-ium-3-yl]methanone
Traditional Name:(3,4-diethoxyphenyl)-[(3S)-piperidin-1-ium-3-yl]methanone
Formula: C16H24NO3+
MolecularWeight: 278.36666
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C2CCC[NH2+]C2)OCC


Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)[C@H]2CCC[NH2+]C2)OCC


InChI

InChI=1S/C16H23NO3/c1-3-19-14-8-7-12(10-15(14)20-4-2)16(18)13-6-5-9-17-11-13/h7-8,10,13,17H,3-6,9,11H2,1-2H3/p+1/t13-/m0/s1


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