(4-ethanoylphenyl) 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (4-ethanoylphenyl) 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (4-acetylphenyl) 2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-chloro-5-(1-pyrrolidinylsulfonyl)benzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 2-chloro-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-pyrrolidinosulfonyl-benzoic acid (4-acetylphenyl) ester Formula: C19H18ClNO5S MolecularWeight: 407.86792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C19H18ClNO5S/c1-13(22)14-4-6-15(7-5-14)26-19(23)17-12-16(8-9-18(17)20)27(24,25)21-10-2-3-11-21/h4-9,12H,2-3,10-11H2,1H3