2-(3-chloranylphenoxy)ethyl 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate

Systemtic Name: 2-(3-chloranylphenoxy)ethyl 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate Openeye Name: 2-(3-chlorophenoxy)ethyl 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(dimethylamino)-3-nitrophenyl]sulfonylamino]acetic acid 2-(3-chlorophenoxy)ethyl ester IUPAC Name: 2-(3-chlorophenoxy)ethyl 2-[[4-(dimethylamino)-3-nitrophenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]acetic acid 2-(3-chlorophenoxy)ethyl ester Formula: C18H20ClN3O7S MolecularWeight: 457.8853

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCCOC2=CC(=CC=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCCOC2=CC(=CC=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H20ClN3O7S/c1-21(2)16-7-6-15(11-17(16)22(24)25)30(26,27)20-12-18(23)29-9-8-28-14-5-3-4-13(19)10-14/h3-7,10-11,20H,8-9,12H2,1-2H3