6-[[[(2S)-2-(diethylamino)-2-phenyl-ethyl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[(2S)-2-(diethylamino)-2-phenyl-ethyl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[(2S)-2-(diethylamino)-2-phenyl-ethyl]amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[(2S)-2-(diethylamino)-2-phenylethyl]amino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[(2S)-2-(diethylamino)-2-phenylethyl]amino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[(2S)-2-(diethylamino)-2-phenyl-ethyl]amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC=C1C=C(C=CC1=O)[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CCN(CC)[C@H](CNC=C1C=C(C=CC1=O)[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C19H23N3O3/c1-3-21(4-2)18(15-8-6-5-7-9-15)14-20-13-16-12-17(22(24)25)10-11-19(16)23/h5-13,18,20H,3-4,14H2,1-2H3/t18-/m1/s1