(E)-but-2-enedioic acid; 2-[cyclohexyl(methyl)amino]-N-methyl-N-[4-nitro-2-(phenylcarbonyl)phenyl]ethanamide

Systemtic Name: (E)-but-2-enedioic acid; 2-[cyclohexyl(methyl)amino]-N-methyl-N-[4-nitro-2-(phenylcarbonyl)phenyl]ethanamide Openeye Name: N-(2-benzoyl-4-nitro-phenyl)-2-[cyclohexyl(methyl)amino]-N-methyl-acetamide; fumaric acid CAS Name: N-(2-benzoyl-4-nitrophenyl)-2-[cyclohexyl(methyl)amino]-N-methylacetamide; (E)-2-butenedioic acid IUPAC Name: N-(2-benzoyl-4-nitrophenyl)-2-[cyclohexyl(methyl)amino]-N-methylacetamide; (E)-but-2-enedioic acid Traditional Name: N-(2-benzoyl-4-nitro-phenyl)-2-[cyclohexyl(methyl)amino]-N-methyl-acetamide; fumaric acid Formula: C27H31N3O8 MolecularWeight: 525.55034

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2)C3CCCCC3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(CC(=O)N(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2)C3CCCCC3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C23H27N3O4.C4H4O4/c1-24(18-11-7-4-8-12-18)16-22(27)25(2)21-14-13-19(26(29)30)15-20(21)23(28)17-9-5-3-6-10-17;5-3(6)1-2-4(7)8/h3,5-6,9-10,13-15,18H,4,7-8,11-12,16H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+