(phenylmethyl) 2-[[2-[(4-nitrophenyl)sulfonylmethyl]-3-phenyl-propanoyl]amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[[2-[(4-nitrophenyl)sulfonylmethyl]-3-phenyl-propanoyl]amino]ethanoate Openeye Name: benzyl 2-[[2-benzyl-3-(4-nitrophenyl)sulfonyl-propanoyl]amino]acetate CAS Name: 2-[[2-[(4-nitrophenyl)sulfonylmethyl]-1-oxo-3-phenylpropyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-benzyl-3-(4-nitrophenyl)sulfonylpropanoyl]amino]acetate Traditional Name: 2-[(2-benzyl-3-nosyl-propanoyl)amino]acetic acid benzyl ester Formula: C25H24N2O7S MolecularWeight: 496.53226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NCC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NCC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H24N2O7S/c28-24(34-17-20-9-5-2-6-10-20)16-26-25(29)21(15-19-7-3-1-4-8-19)18-35(32,33)23-13-11-22(12-14-23)27(30)31/h1-14,21H,15-18H2,(H,26,29)