(4-nitrophenyl)methyl 3-benzamido-2-oxidanyl-3-phenyl-propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-benzamido-2-oxidanyl-3-phenyl-propanoate Openeye Name: (4-nitrophenyl)methyl 3-benzamido-2-hydroxy-3-phenyl-propanoate CAS Name: 3-benzamido-2-hydroxy-3-phenylpropanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-benzamido-2-hydroxy-3-phenylpropanoate Traditional Name: 3-benzamido-2-hydroxy-3-phenyl-propionic acid (4-nitrobenzyl) ester Formula: C23H20N2O6 MolecularWeight: 420.4147

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H20N2O6/c26-21(23(28)31-15-16-11-13-19(14-12-16)25(29)30)20(17-7-3-1-4-8-17)24-22(27)18-9-5-2-6-10-18/h1-14,20-21,26H,15H2,(H,24,27)