(2S,3R,4aS,8aS)-3-methyl-1-nitroso-2-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one

Systemtic Name: (2S,3R,4aS,8aS)-3-methyl-1-nitroso-2-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one Openeye Name: (2S,3R,4aS,8aS)-3-methyl-1-nitroso-2-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one CAS Name: (2S,3R,4aS,8aS)-3-methyl-1-nitroso-2-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one IUPAC Name: (2S,3R,4aS,8aS)-3-methyl-1-nitroso-2-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one Traditional Name: (2S,3R,4aS,8aS)-3-methyl-1-nitroso-2-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(C2CCCCC2C1=O)N=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1[C@H](N([C@H]2CCCC[C@@H]2C1=O)N=O)C3=CC=CC=C3

InChI

InChI=1S/C16H20N2O2/c1-11-15(12-7-3-2-4-8-12)18(17-20)14-10-6-5-9-13(14)16(11)19/h2-4,7-8,11,13-15H,5-6,9-10H2,1H3/t11-,13+,14+,15+/m1/s1