[4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [4-(2-methoxy-2-oxo-ethyl)phenyl] 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid [4-(2-methoxy-2-oxoethyl)phenyl] ester IUPAC Name: [4-(2-methoxy-2-oxoethyl)phenyl] 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid [4-(2-keto-2-methoxy-ethyl)phenyl] ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H21NO6S/c1-26-19(22)13-15-7-9-17(10-8-15)27-20(23)16-5-4-6-18(14-16)28(24,25)21-11-2-3-12-21/h4-10,14H,2-3,11-13H2,1H3