4-chloranyl-6-[[[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-6-[[[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-6-[[[(2S)-2-morpholino-2-(2-thienyl)ethyl]amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-6-[[[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]amino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-6-[[[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-6-[[[(2S)-2-morpholino-2-(2-thienyl)ethyl]amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C17H18ClN3O4S MolecularWeight: 395.86052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CNC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl)C3=CC=CS3

Isomeric SMILES

C1COCCN1[C@@H](CNC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl)C3=CC=CS3

InChI

InChI=1S/C17H18ClN3O4S/c18-13-8-12(17(22)14(9-13)21(23)24)10-19-11-15(16-2-1-7-26-16)20-3-5-25-6-4-20/h1-2,7-10,15,19H,3-6,11H2/t15-/m0/s1