(E)-3-methyl-5-(4-nitrophenyl)-5-phenylazanyl-pent-2-enoic acid

Systemtic Name: (E)-3-methyl-5-(4-nitrophenyl)-5-phenylazanyl-pent-2-enoic acid Openeye Name: (E)-5-anilino-3-methyl-5-(4-nitrophenyl)pent-2-enoic acid CAS Name: (E)-5-anilino-3-methyl-5-(4-nitrophenyl)-2-pentenoic acid IUPAC Name: (E)-5-anilino-3-methyl-5-(4-nitrophenyl)pent-2-enoic acid Traditional Name: (E)-5-anilino-3-methyl-5-(4-nitrophenyl)pent-2-enoic acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)CC(C1=CC=C(C=C1)[N+](=O)[O-])NC2=CC=CC=C2

Isomeric SMILES

C/C(=C\C(=O)O)/CC(C1=CC=C(C=C1)[N+](=O)[O-])NC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O4/c1-13(12-18(21)22)11-17(19-15-5-3-2-4-6-15)14-7-9-16(10-8-14)20(23)24/h2-10,12,17,19H,11H2,1H3,(H,21,22)/b13-12+