methyl 3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]sulfonyl-4-methyl-benzoate

Systemtic Name: methyl 3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]sulfonyl-4-methyl-benzoate Openeye Name: methyl 3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]sulfonyl-4-methyl-benzoate CAS Name: 3-[[2-(4-methoxyphenyl)-1-pyrrolidinyl]sulfonyl]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]sulfonyl-4-methylbenzoate Traditional Name: 3-[2-(4-methoxyphenyl)pyrrolidino]sulfonyl-4-methyl-benzoic acid methyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)N2CCCC2C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)N2CCCC2C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H23NO5S/c1-14-6-7-16(20(22)26-3)13-19(14)27(23,24)21-12-4-5-18(21)15-8-10-17(25-2)11-9-15/h6-11,13,18H,4-5,12H2,1-3H3