(4-aminocarbonyl-2-nitro-phenyl)methyl 3-(5-phenylfuran-2-yl)propanoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 3-(5-phenylfuran-2-yl)propanoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 3-(5-phenyl-2-furyl)propanoate CAS Name: 3-(5-phenyl-2-furanyl)propanoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 3-(5-phenylfuran-2-yl)propanoate Traditional Name: 3-(5-phenyl-2-furyl)propionic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(O2)CCC(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(O2)CCC(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O6/c22-21(25)15-6-7-16(18(12-15)23(26)27)13-28-20(24)11-9-17-8-10-19(29-17)14-4-2-1-3-5-14/h1-8,10,12H,9,11,13H2,(H2,22,25)