(Z)-but-2-enedioate; 2-morpholin-4-yl-N-[4-nitro-2-(phenylcarbonyl)phenyl]-N-propyl-ethanamide

Systemtic Name: (Z)-but-2-enedioate; 2-morpholin-4-yl-N-[4-nitro-2-(phenylcarbonyl)phenyl]-N-propyl-ethanamide Openeye Name: N-(2-benzoyl-4-nitro-phenyl)-2-morpholino-N-propyl-acetamide; (Z)-but-2-enedioate CAS Name: N-(2-benzoyl-4-nitrophenyl)-2-(4-morpholinyl)-N-propylacetamide; (Z)-2-butenedioate IUPAC Name: N-(2-benzoyl-4-nitrophenyl)-2-morpholin-4-yl-N-propylacetamide; (Z)-but-2-enedioate Traditional Name: N-(2-benzoyl-4-nitro-phenyl)-2-morpholino-N-propyl-acetamide maleate Formula: C26H27N3O9-2 MolecularWeight: 525.50728

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2)C(=O)CN3CCOCC3.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCN(C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2)C(=O)CN3CCOCC3.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C22H25N3O5.C4H4O4/c1-2-10-24(21(26)16-23-11-13-30-14-12-23)20-9-8-18(25(28)29)15-19(20)22(27)17-6-4-3-5-7-17;5-3(6)1-2-4(7)8/h3-9,15H,2,10-14,16H2,1H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-