3-phenyl-1-[(3S)-piperidin-1-ium-3-yl]propan-1-one

Systemtic Name: 3-phenyl-1-[(3S)-piperidin-1-ium-3-yl]propan-1-one Openeye Name: 3-phenyl-1-[(3S)-piperidin-1-ium-3-yl]propan-1-one CAS Name: 3-phenyl-1-[(3S)-3-piperidin-1-iumyl]-1-propanone IUPAC Name: 3-phenyl-1-[(3S)-piperidin-1-ium-3-yl]propan-1-one Traditional Name: 3-phenyl-1-[(3S)-piperidin-1-ium-3-yl]propan-1-one Formula: C14H20NO+ MolecularWeight: 218.3147

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)C(=O)CCC2=CC=CC=C2

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)C(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C14H19NO/c16-14(13-7-4-10-15-11-13)9-8-12-5-2-1-3-6-12/h1-3,5-6,13,15H,4,7-11H2/p+1/t13-/m0/s1