N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]pyridine-4-carboxamide

Systemtic Name: N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]pyridine-4-carboxamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]pyridine-4-carboxamide CAS Name: N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-4-pyridinecarboxamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]pyridine-4-carboxamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]isonicotinamide Formula: C17H20N3O+ MolecularWeight: 282.3602

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC(=O)C2=CC=NC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](C[C@H]1NC(=O)C2=CC=NC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H19N3O/c21-17(15-6-9-18-10-7-15)19-16-8-11-20(13-16)12-14-4-2-1-3-5-14/h1-7,9-10,16H,8,11-13H2,(H,19,21)/p+1/t16-/m0/s1