methyl 2-[(2-nitro-4-phenylmethoxy-phenyl)sulfonylamino]propanoate

Systemtic Name: methyl 2-[(2-nitro-4-phenylmethoxy-phenyl)sulfonylamino]propanoate Openeye Name: methyl 2-[(4-benzyloxy-2-nitro-phenyl)sulfonylamino]propanoate CAS Name: 2-[(2-nitro-4-phenylmethoxyphenyl)sulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 2-[(2-nitro-4-phenylmethoxyphenyl)sulfonylamino]propanoate Traditional Name: 2-[(4-benzoxy-2-nitro-phenyl)sulfonylamino]propionic acid methyl ester Formula: C17H18N2O7S MolecularWeight: 394.39902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NS(=O)(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)OC)NS(=O)(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O7S/c1-12(17(20)25-2)18-27(23,24)16-9-8-14(10-15(16)19(21)22)26-11-13-6-4-3-5-7-13/h3-10,12,18H,11H2,1-2H3