2-[3a,8b-bis(bromanyl)-7-methylsulfonyl-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl]ethanoic acid

Systemtic Name: 2-[3a,8b-bis(bromanyl)-7-methylsulfonyl-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl]ethanoic acid Openeye Name: 2-(3a,8b-dibromo-7-methylsulfonyl-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetic acid CAS Name: 2-(3a,8b-dibromo-7-methylsulfonyl-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetic acid IUPAC Name: 2-(3a,8b-dibromo-7-methylsulfonyl-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetic acid Traditional Name: 2-(3a,8b-dibromo-7-mesyl-1,2,3,4-tetrahydrocyclopent[b]indol-3-yl)acetic acid Formula: C14H15Br2NO4S MolecularWeight: 453.1462

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)NC3(C2(CCC3CC(=O)O)Br)Br

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)NC3(C2(CCC3CC(=O)O)Br)Br

InChI

InChI=1S/C14H15Br2NO4S/c1-22(20,21)9-2-3-11-10(7-9)13(15)5-4-8(6-12(18)19)14(13,16)17-11/h2-3,7-8,17H,4-6H2,1H3,(H,18,19)