N-phenethyl-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-phenethyl-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-phenethyl-1-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-phenethyl-1-(3-pyridinylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-phenethyl-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-phenethyl-1-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide Formula: C20H26N3O+ MolecularWeight: 324.43994

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCCC2=CC=CC=C2)CC3=CN=CC=C3

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCCC2=CC=CC=C2)CC3=CN=CC=C3

InChI

InChI=1S/C20H25N3O/c24-20(22-12-8-17-5-2-1-3-6-17)19-9-13-23(14-10-19)16-18-7-4-11-21-15-18/h1-7,11,15,19H,8-10,12-14,16H2,(H,22,24)/p+1