(5-chloranyl-1-methyl-imidazol-2-yl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (5-chloranyl-1-methyl-imidazol-2-yl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (5-chloro-1-methyl-imidazol-2-yl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (5-chloro-1-methyl-2-imidazolyl)methyl ester IUPAC Name: (5-chloro-1-methylimidazol-2-yl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (5-chloro-1-methyl-imidazol-2-yl)methyl ester Formula: C16H18ClN3O4S MolecularWeight: 383.84982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClN3O4S/c1-19-14(17)10-18-15(19)11-24-16(21)12-4-6-13(7-5-12)25(22,23)20-8-2-3-9-20/h4-7,10H,2-3,8-9,11H2,1H3