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N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2,6-dimethoxy-benzamide

N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2,6-dimethoxy-benzamide

Systemtic Name:N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2,6-dimethoxy-benzamide
Openeye Name:N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2,6-dimethoxy-benzamide
CAS Name:N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-2,6-dimethoxybenzamide
IUPAC Name:N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2,6-dimethoxybenzamide
Traditional Name:N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2,6-dimethoxy-benzamide
Formula: C21H33N2O3+
MolecularWeight: 361.49832
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC2CCC[NH+](C2)C3CCCCCC3


Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)N[C@H]2CCC[NH+](C2)C3CCCCCC3


InChI

InChI=1S/C21H32N2O3/c1-25-18-12-7-13-19(26-2)20(18)21(24)22-16-9-8-14-23(15-16)17-10-5-3-4-6-11-17/h7,12-13,16-17H,3-6,8-11,14-15H2,1-2H3,(H,22,24)/p+1/t16-/m0/s1


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