(2S,3S,3aS,6aR)-3-methyl-6a-morpholin-4-yl-2-nitro-2-phenyl-3a,4,5,6-tetrahydro-3H-pentalen-1-one

Systemtic Name: (2S,3S,3aS,6aR)-3-methyl-6a-morpholin-4-yl-2-nitro-2-phenyl-3a,4,5,6-tetrahydro-3H-pentalen-1-one Openeye Name: (2S,3S,3aS,6aR)-3-methyl-6a-morpholino-2-nitro-2-phenyl-3a,4,5,6-tetrahydro-3H-pentalen-1-one CAS Name: (2S,3S,3aS,6aR)-3-methyl-6a-(4-morpholinyl)-2-nitro-2-phenyl-3a,4,5,6-tetrahydro-3H-pentalen-1-one IUPAC Name: (2S,3S,3aS,6aR)-3-methyl-6a-morpholin-4-yl-2-nitro-2-phenyl-3a,4,5,6-tetrahydro-3H-pentalen-1-one Traditional Name: (2S,3S,3aS,6aR)-3-methyl-6a-morpholino-2-nitro-2-phenyl-3a,4,5,6-tetrahydro-3H-pentalen-1-one Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CCCC2(C(=O)C1(C3=CC=CC=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

C[C@H]1[C@@H]2CCC[C@@]2(C(=O)[C@]1(C3=CC=CC=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C19H24N2O4/c1-14-16-8-5-9-18(16,20-10-12-25-13-11-20)17(22)19(14,21(23)24)15-6-3-2-4-7-15/h2-4,6-7,14,16H,5,8-13H2,1H3/t14-,16-,18+,19-/m0/s1