5-chloranyl-N-(3-ethynylphenyl)-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-(3-ethynylphenyl)-2-nitro-benzamide Openeye Name: 5-chloro-N-(3-ethynylphenyl)-2-nitro-benzamide CAS Name: 5-chloro-N-(3-ethynylphenyl)-2-nitrobenzamide IUPAC Name: 5-chloro-N-(3-ethynylphenyl)-2-nitrobenzamide Traditional Name: 5-chloro-N-(3-ethynylphenyl)-2-nitro-benzamide Formula: C15H9ClN2O3 MolecularWeight: 300.69656

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H9ClN2O3/c1-2-10-4-3-5-12(8-10)17-15(19)13-9-11(16)6-7-14(13)18(20)21/h1,3-9H,(H,17,19)