2-chloranyl-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-5-nitro-benzamide Formula: C17H17ClN2O3 MolecularWeight: 332.78148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClN2O3/c1-10-4-6-14(11(2)8-10)12(3)19-17(21)15-9-13(20(22)23)5-7-16(15)18/h4-9,12H,1-3H3,(H,19,21)/t12-/m0/s1