2-[(2-cyano-4-nitro-phenyl)-methyl-amino]-N-(4-morpholin-4-ylphenyl)ethanamide

Systemtic Name: 2-[(2-cyano-4-nitro-phenyl)-methyl-amino]-N-(4-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-(2-cyano-N-methyl-4-nitro-anilino)-N-(4-morpholinophenyl)acetamide CAS Name: 2-(2-cyano-N-methyl-4-nitroanilino)-N-[4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-(2-cyano-N-methyl-4-nitroanilino)-N-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-(2-cyano-N-methyl-4-nitro-anilino)-N-(4-morpholinophenyl)acetamide Formula: C20H21N5O4 MolecularWeight: 395.41184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)N2CCOCC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)N2CCOCC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C20H21N5O4/c1-23(19-7-6-18(25(27)28)12-15(19)13-21)14-20(26)22-16-2-4-17(5-3-16)24-8-10-29-11-9-24/h2-7,12H,8-11,14H2,1H3,(H,22,26)