N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-fluoranyl-4-methoxy-benzamide

Systemtic Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-fluoranyl-4-methoxy-benzamide Openeye Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-fluoro-4-methoxy-benzamide CAS Name: N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-3-fluoro-4-methoxybenzamide IUPAC Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-fluoro-4-methoxybenzamide Traditional Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-fluoro-4-methoxy-benzamide Formula: C20H30FN2O2+ MolecularWeight: 349.462803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29FN2O2/c1-25-19-11-10-15(13-18(19)21)20(24)22-16-7-6-12-23(14-16)17-8-4-2-3-5-9-17/h10-11,13,16-17H,2-9,12,14H2,1H3,(H,22,24)/p+1/t16-/m0/s1