(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(dimethylamino)-3-nitrophenyl]sulfonylamino]acetic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 2-[[4-(dimethylamino)-3-nitrophenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]acetic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C18H20N4O7S MolecularWeight: 436.439

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OC(C2=CC=CC=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OC(C2=CC=CC=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O7S/c1-21(2)14-9-8-13(10-15(14)22(25)26)30(27,28)20-11-16(23)29-17(18(19)24)12-6-4-3-5-7-12/h3-10,17,20H,11H2,1-2H3,(H2,19,24)