N-methyl-2-(2-methylbut-3-yn-2-ylamino)-N-[4-nitro-2-(phenylcarbonyl)phenyl]ethanamide

Systemtic Name: N-methyl-2-(2-methylbut-3-yn-2-ylamino)-N-[4-nitro-2-(phenylcarbonyl)phenyl]ethanamide Openeye Name: N-(2-benzoyl-4-nitro-phenyl)-2-(1,1-dimethylprop-2-ynylamino)-N-methyl-acetamide CAS Name: N-(2-benzoyl-4-nitrophenyl)-N-methyl-2-(2-methylbut-3-yn-2-ylamino)acetamide IUPAC Name: N-(2-benzoyl-4-nitrophenyl)-N-methyl-2-(2-methylbut-3-yn-2-ylamino)acetamide Traditional Name: N-(2-benzoyl-4-nitro-phenyl)-2-(1,1-dimethylprop-2-ynylamino)-N-methyl-acetamide Formula: C21H21N3O4 MolecularWeight: 379.40914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4/c1-5-21(2,3)22-14-19(25)23(4)18-12-11-16(24(27)28)13-17(18)20(26)15-9-7-6-8-10-15/h1,6-13,22H,14H2,2-4H3