N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-2-nitro-phenoxy)ethanamide Openeye Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-2-nitro-phenoxy)acetamide CAS Name: N-[[[(1S,2S)-2-methylcyclohexyl]amino]-oxomethyl]-2-(4-methyl-2-nitrophenoxy)acetamide IUPAC Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-2-nitrophenoxy)acetamide Traditional Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-2-nitro-phenoxy)acetamide Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(=O)COC2=C(C=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)COC2=C(C=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O5/c1-11-7-8-15(14(9-11)20(23)24)25-10-16(21)19-17(22)18-13-6-4-3-5-12(13)2/h7-9,12-13H,3-6,10H2,1-2H3,(H2,18,19,21,22)/t12-,13-/m0/s1