(5-chloranyl-1-methyl-imidazol-2-yl)methyl 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (5-chloranyl-1-methyl-imidazol-2-yl)methyl 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (5-chloro-1-methyl-imidazol-2-yl)methyl 2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-chloro-5-(1-pyrrolidinylsulfonyl)benzoic acid (5-chloro-1-methyl-2-imidazolyl)methyl ester IUPAC Name: (5-chloro-1-methylimidazol-2-yl)methyl 2-chloro-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-pyrrolidinosulfonyl-benzoic acid (5-chloro-1-methyl-imidazol-2-yl)methyl ester Formula: C16H17Cl2N3O4S MolecularWeight: 418.29488

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl)Cl

Isomeric SMILES

CN1C(=CN=C1COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl)Cl

InChI

InChI=1S/C16H17Cl2N3O4S/c1-20-14(18)9-19-15(20)10-25-16(22)12-8-11(4-5-13(12)17)26(23,24)21-6-2-3-7-21/h4-5,8-9H,2-3,6-7,10H2,1H3