6-[[[(1R,2S)-1-morpholin-4-yl-1-phenyl-propan-2-yl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[(1R,2S)-1-morpholin-4-yl-1-phenyl-propan-2-yl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[(1S,2R)-1-methyl-2-morpholino-2-phenyl-ethyl]amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[(1R,2S)-1-(4-morpholinyl)-1-phenylpropan-2-yl]amino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[(1R,2S)-1-morpholin-4-yl-1-phenylpropan-2-yl]amino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[(1S,2R)-1-methyl-2-morpholino-2-phenyl-ethyl]amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)N2CCOCC2)NC=C3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

C[C@@H]([C@@H](C1=CC=CC=C1)N2CCOCC2)NC=C3C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O4/c1-15(21-14-17-13-18(23(25)26)7-8-19(17)24)20(16-5-3-2-4-6-16)22-9-11-27-12-10-22/h2-8,13-15,20-21H,9-12H2,1H3/t15-,20-/m0/s1