2-azanyl-N-[2-(3-nitrophenyl)-1-phenyl-propan-2-yl]ethanamide; (E)-but-2-enedioic acid

Systemtic Name: 2-azanyl-N-[2-(3-nitrophenyl)-1-phenyl-propan-2-yl]ethanamide; (E)-but-2-enedioic acid Openeye Name: 2-amino-N-[1-methyl-1-(3-nitrophenyl)-2-phenyl-ethyl]acetamide; fumaric acid CAS Name: 2-amino-N-[2-(3-nitrophenyl)-1-phenylpropan-2-yl]acetamide; (E)-2-butenedioic acid IUPAC Name: 2-amino-N-[2-(3-nitrophenyl)-1-phenylpropan-2-yl]acetamide; (E)-but-2-enedioic acid Traditional Name: 2-amino-N-[1-methyl-1-(3-nitrophenyl)-2-phenyl-ethyl]acetamide; fumaric acid Formula: C21H23N3O7 MolecularWeight: 429.42322

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)(C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)CN.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(CC1=CC=CC=C1)(C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)CN.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C17H19N3O3.C4H4O4/c1-17(19-16(21)12-18,11-13-6-3-2-4-7-13)14-8-5-9-15(10-14)20(22)23;5-3(6)1-2-4(7)8/h2-10H,11-12,18H2,1H3,(H,19,21);1-2H,(H,5,6)(H,7,8)/b;2-1+