4-chloranyl-N-[(1S,2S)-2-methylcyclohexyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[(1S,2S)-2-methylcyclohexyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S,2S)-2-methylcyclohexyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(1S,2S)-2-methylcyclohexyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(1S,2S)-2-methylcyclohexyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S,2S)-2-methylcyclohexyl]-3-nitro-benzamide Formula: C14H17ClN2O3 MolecularWeight: 296.74938

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H17ClN2O3/c1-9-4-2-3-5-12(9)16-14(18)10-6-7-11(15)13(8-10)17(19)20/h6-9,12H,2-5H2,1H3,(H,16,18)/t9-,12-/m0/s1