N-[(3S)-piperidin-1-ium-3-yl]-4-propan-2-yl-benzamide

Systemtic Name: N-[(3S)-piperidin-1-ium-3-yl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide CAS Name: N-[(3S)-3-piperidin-1-iumyl]-4-propan-2-ylbenzamide IUPAC Name: N-[(3S)-piperidin-1-ium-3-yl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide Formula: C15H23N2O+ MolecularWeight: 247.35592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O/c1-11(2)12-5-7-13(8-6-12)15(18)17-14-4-3-9-16-10-14/h5-8,11,14,16H,3-4,9-10H2,1-2H3,(H,17,18)/p+1/t14-/m0/s1