N-methyl-N-(4-nitrophenyl)-4-(phenylmethyl)pyridin-1-ium-1-carboxamide

Systemtic Name: N-methyl-N-(4-nitrophenyl)-4-(phenylmethyl)pyridin-1-ium-1-carboxamide Openeye Name: 4-benzyl-N-methyl-N-(4-nitrophenyl)pyridin-1-ium-1-carboxamide CAS Name: N-methyl-N-(4-nitrophenyl)-4-(phenylmethyl)-1-pyridin-1-iumcarboxamide IUPAC Name: 4-benzyl-N-methyl-N-(4-nitrophenyl)pyridin-1-ium-1-carboxamide Traditional Name: 4-benzyl-N-methyl-N-(4-nitrophenyl)pyridin-1-ium-1-carboxamide Formula: C20H18N3O3+ MolecularWeight: 348.37522

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)[N+]2=CC=C(C=C2)CC3=CC=CC=C3

Isomeric SMILES

CN(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)[N+]2=CC=C(C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H18N3O3/c1-21(18-7-9-19(10-8-18)23(25)26)20(24)22-13-11-17(12-14-22)15-16-5-3-2-4-6-16/h2-14H,15H2,1H3/q+1