2-(3-methylphenoxy)ethyl 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: 2-(3-methylphenoxy)ethyl 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: 2-(3-methylphenoxy)ethyl 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-methoxy-3-(1-pyrrolidinylsulfonyl)benzoic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl 4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-benzoic acid 2-(3-methylphenoxy)ethyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO6S/c1-16-6-5-7-18(14-16)27-12-13-28-21(23)17-8-9-19(26-2)20(15-17)29(24,25)22-10-3-4-11-22/h5-9,14-15H,3-4,10-13H2,1-2H3