(4-bromanyl-2-chloranyl-6-methyl-phenyl) 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (4-bromanyl-2-chloranyl-6-methyl-phenyl) 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (4-bromo-2-chloro-6-methyl-phenyl) 4-chloro-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(1-pyrrolidinylsulfonyl)benzoic acid (4-bromo-2-chloro-6-methylphenyl) ester IUPAC Name: (4-bromo-2-chloro-6-methylphenyl) 4-chloro-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-pyrrolidinosulfonyl-benzoic acid (4-bromo-2-chloro-6-methyl-phenyl) ester Formula: C18H16BrCl2NO4S MolecularWeight: 493.19894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3)Cl)Br

InChI

InChI=1S/C18H16BrCl2NO4S/c1-11-8-13(19)10-15(21)17(11)26-18(23)12-4-5-14(20)16(9-12)27(24,25)22-6-2-3-7-22/h4-5,8-10H,2-3,6-7H2,1H3