(E)-N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(4-chloranyl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(4-chloranyl-3-nitro-phenyl)prop-2-enamide Openeye Name: (E)-N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(4-chloro-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(4-chloro-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(4-chloro-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(4-chloro-3-nitro-phenyl)acrylamide Formula: C22H15ClN4O3 MolecularWeight: 418.8325

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=O)C=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=O)/C=C/C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H15ClN4O3/c23-17-11-5-14(13-20(17)27(29)30)6-12-21(28)24-16-9-7-15(8-10-16)22-25-18-3-1-2-4-19(18)26-22/h1-13H,(H,24,28)(H,25,26)/b12-6+