4-chloranyl-N-(2-methyl-6-propan-2-yl-phenyl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(2-methyl-6-propan-2-yl-phenyl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(2-isopropyl-6-methyl-phenyl)-3-nitro-benzamide CAS Name: 4-chloro-N-(2-methyl-6-propan-2-ylphenyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-(2-methyl-6-propan-2-ylphenyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(2-isopropyl-6-methyl-phenyl)-3-nitro-benzamide Formula: C17H17ClN2O3 MolecularWeight: 332.78148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClN2O3/c1-10(2)13-6-4-5-11(3)16(13)19-17(21)12-7-8-14(18)15(9-12)20(22)23/h4-10H,1-3H3,(H,19,21)