N-(1H-benzimidazol-2-ylmethyl)-4-(3-nitropyrazol-1-yl)butanamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-4-(3-nitropyrazol-1-yl)butanamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-4-(3-nitropyrazol-1-yl)butanamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-4-(3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-4-(3-nitropyrazol-1-yl)butanamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-4-(3-nitropyrazol-1-yl)butyramide Formula: C15H16N6O3 MolecularWeight: 328.32594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CNC(=O)CCCN3C=CC(=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CNC(=O)CCCN3C=CC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C15H16N6O3/c22-15(6-3-8-20-9-7-14(19-20)21(23)24)16-10-13-17-11-4-1-2-5-12(11)18-13/h1-2,4-5,7,9H,3,6,8,10H2,(H,16,22)(H,17,18)