4-chloranyl-N-(3,5-ditert-butylphenyl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(3,5-ditert-butylphenyl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(3,5-ditert-butylphenyl)-3-nitro-benzamide CAS Name: 4-chloro-N-(3,5-ditert-butylphenyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-(3,5-ditert-butylphenyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(3,5-ditert-butylphenyl)-3-nitro-benzamide Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O3/c1-20(2,3)14-10-15(21(4,5)6)12-16(11-14)23-19(25)13-7-8-17(22)18(9-13)24(26)27/h7-12H,1-6H3,(H,23,25)