N-(3-ethynylphenyl)-3-methyl-2-nitro-benzamide

Systemtic Name: N-(3-ethynylphenyl)-3-methyl-2-nitro-benzamide Openeye Name: N-(3-ethynylphenyl)-3-methyl-2-nitro-benzamide CAS Name: N-(3-ethynylphenyl)-3-methyl-2-nitrobenzamide IUPAC Name: N-(3-ethynylphenyl)-3-methyl-2-nitrobenzamide Traditional Name: N-(3-ethynylphenyl)-3-methyl-2-nitro-benzamide Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=CC(=C2)C#C

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C16H12N2O3/c1-3-12-7-5-8-13(10-12)17-16(19)14-9-4-6-11(2)15(14)18(20)21/h1,4-10H,2H3,(H,17,19)