N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-nitropyrazol-1-yl)butyramide Formula: C16H18N6O3 MolecularWeight: 342.35252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N6O3/c23-16(6-3-9-21-11-12(10-18-21)22(24)25)17-8-7-15-19-13-4-1-2-5-14(13)20-15/h1-2,4-5,10-11H,3,6-9H2,(H,17,23)(H,19,20)