3-ethyl-1-(furan-2-ylcarbonyl)-2-methyl-indole-5-sulfonic acid

Systemtic Name: 3-ethyl-1-(furan-2-ylcarbonyl)-2-methyl-indole-5-sulfonic acid Openeye Name: 3-ethyl-1-(furan-2-carbonyl)-2-methyl-indole-5-sulfonic acid CAS Name: 3-ethyl-1-[2-furanyl(oxo)methyl]-2-methyl-5-indolesulfonic acid IUPAC Name: 3-ethyl-1-(furan-2-carbonyl)-2-methylindole-5-sulfonic acid Traditional Name: 3-ethyl-1-(2-furoyl)-2-methyl-indole-5-sulfonic acid Formula: C16H15NO5S MolecularWeight: 333.359

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C2=C1C=C(C=C2)S(=O)(=O)O)C(=O)C3=CC=CO3)C

Isomeric SMILES

CCC1=C(N(C2=C1C=C(C=C2)S(=O)(=O)O)C(=O)C3=CC=CO3)C

InChI

InChI=1S/C16H15NO5S/c1-3-12-10(2)17(16(18)15-5-4-8-22-15)14-7-6-11(9-13(12)14)23(19,20)21/h4-9H,3H2,1-2H3,(H,19,20,21)