N-(3-oxidanylpropyl)-1-(phenylmethyl)pyridin-1-ium-4-carboxamide

Systemtic Name: N-(3-oxidanylpropyl)-1-(phenylmethyl)pyridin-1-ium-4-carboxamide Openeye Name: 1-benzyl-N-(3-hydroxypropyl)pyridin-1-ium-4-carboxamide CAS Name: N-(3-hydroxypropyl)-1-(phenylmethyl)-4-pyridin-1-iumcarboxamide IUPAC Name: 1-benzyl-N-(3-hydroxypropyl)pyridin-1-ium-4-carboxamide Traditional Name: 1-benzyl-N-(3-hydroxypropyl)pyridin-1-ium-4-carboxamide Formula: C16H19N2O2+ MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C(=O)NCCCO

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C(=O)NCCCO

InChI

InChI=1S/C16H18N2O2/c19-12-4-9-17-16(20)15-7-10-18(11-8-15)13-14-5-2-1-3-6-14/h1-3,5-8,10-11,19H,4,9,12-13H2/p+1