3-cyanopropyl 2-[[4-bromanyl-2,6-bis(chloranyl)phenyl]sulfonylamino]ethanoate

Systemtic Name: 3-cyanopropyl 2-[[4-bromanyl-2,6-bis(chloranyl)phenyl]sulfonylamino]ethanoate Openeye Name: 3-cyanopropyl 2-[(4-bromo-2,6-dichloro-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-bromo-2,6-dichlorophenyl)sulfonylamino]acetic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 2-[(4-bromo-2,6-dichlorophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-bromo-2,6-dichloro-phenyl)sulfonylamino]acetic acid 3-cyanopropyl ester Formula: C12H11BrCl2N2O4S MolecularWeight: 430.10174

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)S(=O)(=O)NCC(=O)OCCCC#N)Cl)Br

Isomeric SMILES

C1=C(C=C(C(=C1Cl)S(=O)(=O)NCC(=O)OCCCC#N)Cl)Br

InChI

InChI=1S/C12H11BrCl2N2O4S/c13-8-5-9(14)12(10(15)6-8)22(19,20)17-7-11(18)21-4-2-1-3-16/h5-6,17H,1-2,4,7H2