5-[5-(3-methylpiperidin-1-yl)sulfonyl-2,3-dihydroindol-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[5-(3-methylpiperidin-1-yl)sulfonyl-2,3-dihydroindol-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[5-[(3-methyl-1-piperidyl)sulfonyl]indolin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[5-[(3-methyl-1-piperidinyl)sulfonyl]-2,3-dihydroindol-1-yl]-5-oxopentanoic acid IUPAC Name: 5-[5-(3-methylpiperidin-1-yl)sulfonyl-2,3-dihydroindol-1-yl]-5-oxopentanoic acid Traditional Name: 5-keto-5-[5-(3-methylpiperidino)sulfonylindolin-1-yl]valeric acid Formula: C19H26N2O5S MolecularWeight: 394.48514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(=O)CCCC(=O)O

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(=O)CCCC(=O)O

InChI

InChI=1S/C19H26N2O5S/c1-14-4-3-10-20(13-14)27(25,26)16-7-8-17-15(12-16)9-11-21(17)18(22)5-2-6-19(23)24/h7-8,12,14H,2-6,9-11,13H2,1H3,(H,23,24)