N-[4-(1H-benzimidazol-3-ium-2-yl)phenyl]-2-chloranyl-5-nitro-benzamide

Systemtic Name: N-[4-(1H-benzimidazol-3-ium-2-yl)phenyl]-2-chloranyl-5-nitro-benzamide Openeye Name: N-[4-(1H-benzimidazol-3-ium-2-yl)phenyl]-2-chloro-5-nitro-benzamide CAS Name: N-[4-(1H-benzimidazol-3-ium-2-yl)phenyl]-2-chloro-5-nitrobenzamide IUPAC Name: N-[4-(1H-benzimidazol-3-ium-2-yl)phenyl]-2-chloro-5-nitrobenzamide Traditional Name: N-[4-(1H-benzimidazol-3-ium-2-yl)phenyl]-2-chloro-5-nitro-benzamide Formula: C20H14ClN4O3+ MolecularWeight: 393.80316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[NH+]2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[NH+]2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H13ClN4O3/c21-16-10-9-14(25(27)28)11-15(16)20(26)22-13-7-5-12(6-8-13)19-23-17-3-1-2-4-18(17)24-19/h1-11H,(H,22,26)(H,23,24)/p+1