1-ethyl-3-phenyl-N4-(phenylmethyl)pyridin-1-ium-2,4-diamine chloride

Systemtic Name: 1-ethyl-3-phenyl-N4-(phenylmethyl)pyridin-1-ium-2,4-diamine chloride Openeye Name: N4-benzyl-1-ethyl-3-phenyl-pyridin-1-ium-2,4-diamine chloride CAS Name: 1-ethyl-3-phenyl-N4-(phenylmethyl)pyridin-1-ium-2,4-diamine chloride IUPAC Name: 4-N-benzyl-1-ethyl-3-phenylpyridin-1-ium-2,4-diamine chloride Traditional Name: (2-amino-1-ethyl-3-phenyl-pyridin-1-ium-4-yl)-benzyl-amine chloride Formula: C20H22ClN3 MolecularWeight: 339.86178

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C(=C(C=C1)NCC2=CC=CC=C2)C3=CC=CC=C3)N.[Cl-]

Isomeric SMILES

CC[N+]1=C(C(=C(C=C1)NCC2=CC=CC=C2)C3=CC=CC=C3)N.[Cl-]

InChI

InChI=1S/C20H21N3.ClH/c1-2-23-14-13-18(22-15-16-9-5-3-6-10-16)19(20(23)21)17-11-7-4-8-12-17;/h3-14H,2,15H2,1H3,(H2,21,22);1H