4,5-dimethoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-2-nitro-benzamide

Systemtic Name: 4,5-dimethoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-2-nitro-benzamide Openeye Name: 4,5-dimethoxy-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-2-nitro-benzamide CAS Name: 4,5-dimethoxy-N-[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]-2-nitrobenzamide IUPAC Name: 4,5-dimethoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-nitrobenzamide Traditional Name: 4,5-dimethoxy-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-2-nitro-benzamide Formula: C19H23N3O6S MolecularWeight: 421.46742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NCC(C2=CC=CS2)N3CCOCC3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC[C@@H](C2=CC=CS2)N3CCOCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H23N3O6S/c1-26-16-10-13(14(22(24)25)11-17(16)27-2)19(23)20-12-15(18-4-3-9-29-18)21-5-7-28-8-6-21/h3-4,9-11,15H,5-8,12H2,1-2H3,(H,20,23)/t15-/m0/s1