(3R,6R)-3-methyl-2-[(3-nitrophenyl)methylidene]-6-propan-2-yl-cyclohexan-1-one

Systemtic Name: (3R,6R)-3-methyl-2-[(3-nitrophenyl)methylidene]-6-propan-2-yl-cyclohexan-1-one Openeye Name: (3R,6R)-6-isopropyl-3-methyl-2-[(3-nitrophenyl)methylene]cyclohexanone CAS Name: (3R,6R)-3-methyl-2-[(3-nitrophenyl)methylidene]-6-propan-2-yl-1-cyclohexanone IUPAC Name: (3R,6R)-3-methyl-2-[(3-nitrophenyl)methylidene]-6-propan-2-ylcyclohexan-1-one Traditional Name: (3R,6R)-6-isopropyl-3-methyl-2-(3-nitrobenzylidene)cyclohexanone Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)C1=CC2=CC(=CC=C2)[N+](=O)[O-])C(C)C

Isomeric SMILES

C[C@@H]1CC[C@@H](C(=O)C1=CC2=CC(=CC=C2)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C17H21NO3/c1-11(2)15-8-7-12(3)16(17(15)19)10-13-5-4-6-14(9-13)18(20)21/h4-6,9-12,15H,7-8H2,1-3H3/t12-,15-/m1/s1