methyl 4-[2-(phenylmethyl)pyrrolidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 4-[2-(phenylmethyl)pyrrolidin-1-yl]sulfonylbenzoate Openeye Name: methyl 4-(2-benzylpyrrolidin-1-yl)sulfonylbenzoate CAS Name: 4-[[2-(phenylmethyl)-1-pyrrolidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-(2-benzylpyrrolidin-1-yl)sulfonylbenzoate Traditional Name: 4-(2-benzylpyrrolidino)sulfonylbenzoic acid methyl ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2CC3=CC=CC=C3

InChI

InChI=1S/C19H21NO4S/c1-24-19(21)16-9-11-18(12-10-16)25(22,23)20-13-5-8-17(20)14-15-6-3-2-4-7-15/h2-4,6-7,9-12,17H,5,8,13-14H2,1H3