methyl 5-(4-butylsulfonylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: methyl 5-(4-butylsulfonylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: methyl 5-(4-butylsulfonylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-[(4-butylsulfonylphenyl)-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-butylsulfonylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-(4-butylsulfonylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=CC=C(C=C1)C(=O)C2=CC=C3N2CCC3C(=O)OC

Isomeric SMILES

CCCCS(=O)(=O)C1=CC=C(C=C1)C(=O)C2=CC=C3N2CCC3C(=O)OC

InChI

InChI=1S/C20H23NO5S/c1-3-4-13-27(24,25)15-7-5-14(6-8-15)19(22)18-10-9-17-16(20(23)26-2)11-12-21(17)18/h5-10,16H,3-4,11-13H2,1-2H3