[3-[[(3S)-3-aminocarbonylpiperidin-1-ium-1-yl]methyl]phenyl]methylazanium

Systemtic Name: [3-[[(3S)-3-aminocarbonylpiperidin-1-ium-1-yl]methyl]phenyl]methylazanium Openeye Name: [3-[[(3S)-3-carbamoylpiperidin-1-ium-1-yl]methyl]phenyl]methylammonium CAS Name: [3-[[(3S)-3-carbamoyl-1-piperidin-1-iumyl]methyl]phenyl]methylammonium IUPAC Name: [3-[[(3S)-3-carbamoylpiperidin-1-ium-1-yl]methyl]phenyl]methylazanium Traditional Name: [3-[[(3S)-3-carbamoylpiperidin-1-ium-1-yl]methyl]benzyl]ammonium Formula: C14H23N3O+2 MolecularWeight: 249.35192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC(=CC=C2)C[NH3+])C(=O)N

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC(=CC=C2)C[NH3+])C(=O)N

InChI

InChI=1S/C14H21N3O/c15-8-11-3-1-4-12(7-11)9-17-6-2-5-13(10-17)14(16)18/h1,3-4,7,13H,2,5-6,8-10,15H2,(H2,16,18)/p+2/t13-/m0/s1