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

Systemtic Name: 4,5-dimethoxy-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-yl-ethyl]-2-nitro-benzamide Openeye Name: 4,5-dimethoxy-N-[(2R)-2-morpholino-2-(p-tolyl)ethyl]-2-nitro-benzamide CAS Name: 4,5-dimethoxy-N-[(2R)-2-(4-methylphenyl)-2-(4-morpholinyl)ethyl]-2-nitrobenzamide IUPAC Name: 4,5-dimethoxy-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]-2-nitrobenzamide Traditional Name: 4,5-dimethoxy-N-[(2R)-2-morpholino-2-(p-tolyl)ethyl]-2-nitro-benzamide Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CNC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)N3CCOCC3

InChI

InChI=1S/C22H27N3O6/c1-15-4-6-16(7-5-15)19(24-8-10-31-11-9-24)14-23-22(26)17-12-20(29-2)21(30-3)13-18(17)25(27)28/h4-7,12-13,19H,8-11,14H2,1-3H3,(H,23,26)/t19-/m0/s1