phenyl 2-[[1-[(4-bromophenyl)sulfonylamino]cyclopentyl]methyl]butanoate

Systemtic Name: phenyl 2-[[1-[(4-bromophenyl)sulfonylamino]cyclopentyl]methyl]butanoate Openeye Name: phenyl 2-[[1-[(4-bromophenyl)sulfonylamino]cyclopentyl]methyl]butanoate CAS Name: 2-[[1-[(4-bromophenyl)sulfonylamino]cyclopentyl]methyl]butanoic acid phenyl ester IUPAC Name: phenyl 2-[[1-[(4-bromophenyl)sulfonylamino]cyclopentyl]methyl]butanoate Traditional Name: 2-[[1-(brosylamino)cyclopentyl]methyl]butyric acid phenyl ester Formula: C22H26BrNO4S MolecularWeight: 480.41514

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1(CCCC1)NS(=O)(=O)C2=CC=C(C=C2)Br)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CCC(CC1(CCCC1)NS(=O)(=O)C2=CC=C(C=C2)Br)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C22H26BrNO4S/c1-2-17(21(25)28-19-8-4-3-5-9-19)16-22(14-6-7-15-22)24-29(26,27)20-12-10-18(23)11-13-20/h3-5,8-13,17,24H,2,6-7,14-16H2,1H3