2-[(1-cyclobutylcarbonyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(1-cyclobutylcarbonyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl-methyl-amino]ethanoic acid Openeye Name: 2-[[1-(cyclobutanecarbonyl)-2-methyl-indolin-5-yl]sulfonyl-methyl-amino]acetic acid CAS Name: 2-[[1-[cyclobutyl(oxo)methyl]-2-methyl-2,3-dihydroindol-5-yl]sulfonyl-methylamino]acetic acid IUPAC Name: 2-[[1-(cyclobutanecarbonyl)-2-methyl-2,3-dihydroindol-5-yl]sulfonyl-methylamino]acetic acid Traditional Name: 2-[[1-(cyclobutanecarbonyl)-2-methyl-indolin-5-yl]sulfonyl-methyl-amino]acetic acid Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1C(=O)C3CCC3)C=CC(=C2)S(=O)(=O)N(C)CC(=O)O

Isomeric SMILES

CC1CC2=C(N1C(=O)C3CCC3)C=CC(=C2)S(=O)(=O)N(C)CC(=O)O

InChI

InChI=1S/C17H22N2O5S/c1-11-8-13-9-14(25(23,24)18(2)10-16(20)21)6-7-15(13)19(11)17(22)12-4-3-5-12/h6-7,9,11-12H,3-5,8,10H2,1-2H3,(H,20,21)