phenacyl 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: phenacyl 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: phenacyl 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-methoxy-3-(1-pyrrolidinylsulfonyl)benzoic acid phenacyl ester IUPAC Name: phenacyl 4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-benzoic acid phenacyl ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H21NO6S/c1-26-18-10-9-16(13-19(18)28(24,25)21-11-5-6-12-21)20(23)27-14-17(22)15-7-3-2-4-8-15/h2-4,7-10,13H,5-6,11-12,14H2,1H3