1-(2-acetyloxypropyl)-2-methyl-3H-indole-2-sulfonic acid

Systemtic Name: 1-(2-acetyloxypropyl)-2-methyl-3H-indole-2-sulfonic acid Openeye Name: 1-(2-acetoxypropyl)-2-methyl-indoline-2-sulfonic acid CAS Name: 1-(2-acetyloxypropyl)-2-methyl-3H-indole-2-sulfonic acid IUPAC Name: 1-(2-acetyloxypropyl)-2-methyl-3H-indole-2-sulfonic acid Traditional Name: 1-(2-acetoxypropyl)-2-methyl-indoline-2-sulfonic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=CC=CC=C2CC1(C)S(=O)(=O)O)OC(=O)C

Isomeric SMILES

CC(CN1C2=CC=CC=C2CC1(C)S(=O)(=O)O)OC(=O)C

InChI

InChI=1S/C14H19NO5S/c1-10(20-11(2)16)9-15-13-7-5-4-6-12(13)8-14(15,3)21(17,18)19/h4-7,10H,8-9H2,1-3H3,(H,17,18,19)