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

Systemtic Name: 4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitro-benzamide Openeye Name: 4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitro-benzamide CAS Name: 4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitrobenzamide IUPAC Name: 4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitrobenzamide Traditional Name: 4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitro-benzamide Formula: C14H19N3O3 MolecularWeight: 277.31896

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O3/c1-9-4-2-3-5-11(9)16-12-7-6-10(14(15)18)8-13(12)17(19)20/h6-9,11,16H,2-5H2,1H3,(H2,15,18)/t9-,11-/m0/s1