2-(3,3-dimethyl-5-piperidin-1-ylsulfonyl-2H-indol-1-yl)ethanoic acid

Systemtic Name: 2-(3,3-dimethyl-5-piperidin-1-ylsulfonyl-2H-indol-1-yl)ethanoic acid Openeye Name: 2-[3,3-dimethyl-5-(1-piperidylsulfonyl)indolin-1-yl]acetic acid CAS Name: 2-[3,3-dimethyl-5-(1-piperidinylsulfonyl)-2H-indol-1-yl]acetic acid IUPAC Name: 2-(3,3-dimethyl-5-piperidin-1-ylsulfonyl-2H-indol-1-yl)acetic acid Traditional Name: 2-(3,3-dimethyl-5-piperidinosulfonyl-indolin-1-yl)acetic acid Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3)CC(=O)O)C

Isomeric SMILES

CC1(CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3)CC(=O)O)C

InChI

InChI=1S/C17H24N2O4S/c1-17(2)12-18(11-16(20)21)15-7-6-13(10-14(15)17)24(22,23)19-8-4-3-5-9-19/h6-7,10H,3-5,8-9,11-12H2,1-2H3,(H,20,21)