(3S)-1-(1-phenethylpiperidin-4-yl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-(1-phenethylpiperidin-4-yl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-(1-phenethyl-4-piperidyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-(1-phenethyl-4-piperidinyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-(1-phenethylpiperidin-4-yl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-(1-phenethyl-4-piperidyl)piperidin-1-ium-3-carboxamide Formula: C19H30N3O+ MolecularWeight: 316.461

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CCN(CC2)CCC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CCN(CC2)CCC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C19H29N3O/c20-19(23)17-7-4-11-22(15-17)18-9-13-21(14-10-18)12-8-16-5-2-1-3-6-16/h1-3,5-6,17-18H,4,7-15H2,(H2,20,23)/p+1/t17-/m0/s1