(4-aminocarbonyl-2-nitro-phenyl)methyl 2-phenethylbenzoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 2-phenethylbenzoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 2-phenethylbenzoate CAS Name: 2-phenethylbenzoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 2-phenethylbenzoate Traditional Name: 2-phenethylbenzoic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=CC=C2C(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=CC=C2C(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C23H20N2O5/c24-22(26)18-12-13-19(21(14-18)25(28)29)15-30-23(27)20-9-5-4-8-17(20)11-10-16-6-2-1-3-7-16/h1-9,12-14H,10-11,15H2,(H2,24,26)