3-(3H-benzimidazol-1-ium-1-yl)-N-(pyridin-3-ylmethylideneamino)propanamide

Systemtic Name: 3-(3H-benzimidazol-1-ium-1-yl)-N-(pyridin-3-ylmethylideneamino)propanamide Openeye Name: 3-(3H-benzimidazol-1-ium-1-yl)-N-(3-pyridylmethyleneamino)propanamide CAS Name: 3-(3H-benzimidazol-1-ium-1-yl)-N-(3-pyridinylmethylideneamino)propanamide IUPAC Name: 3-(3H-benzimidazol-1-ium-1-yl)-N-(pyridin-3-ylmethylideneamino)propanamide Traditional Name: 3-(3H-benzimidazol-1-ium-1-yl)-N-(3-pyridylmethyleneamino)propionamide Formula: C16H16N5O+ MolecularWeight: 294.33114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC=[N+]2CCC(=O)NN=CC3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)NC=[N+]2CCC(=O)NN=CC3=CN=CC=C3

InChI

InChI=1S/C16H15N5O/c22-16(20-19-11-13-4-3-8-17-10-13)7-9-21-12-18-14-5-1-2-6-15(14)21/h1-6,8,10-12H,7,9H2,(H,20,22)/p+1