4-butoxy-N-[(3S)-piperidin-1-ium-3-yl]benzamide

Systemtic Name: 4-butoxy-N-[(3S)-piperidin-1-ium-3-yl]benzamide Openeye Name: 4-butoxy-N-[(3S)-piperidin-1-ium-3-yl]benzamide CAS Name: 4-butoxy-N-[(3S)-3-piperidin-1-iumyl]benzamide IUPAC Name: 4-butoxy-N-[(3S)-piperidin-1-ium-3-yl]benzamide Traditional Name: 4-butoxy-N-[(3S)-piperidin-1-ium-3-yl]benzamide Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2CCC[NH2+]C2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C16H24N2O2/c1-2-3-11-20-15-8-6-13(7-9-15)16(19)18-14-5-4-10-17-12-14/h6-9,14,17H,2-5,10-12H2,1H3,(H,18,19)/p+1/t14-/m0/s1