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

Systemtic Name: 3-decyl-1-(furan-2-ylcarbonyl)indole-5-sulfonic acid Openeye Name: 3-decyl-1-(furan-2-carbonyl)indole-5-sulfonic acid CAS Name: 3-decyl-1-[2-furanyl(oxo)methyl]-5-indolesulfonic acid IUPAC Name: 3-decyl-1-(furan-2-carbonyl)indole-5-sulfonic acid Traditional Name: 3-decyl-1-(2-furoyl)indole-5-sulfonic acid Formula: C23H29NO5S MolecularWeight: 431.54506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN(C2=C1C=C(C=C2)S(=O)(=O)O)C(=O)C3=CC=CO3

Isomeric SMILES

CCCCCCCCCCC1=CN(C2=C1C=C(C=C2)S(=O)(=O)O)C(=O)C3=CC=CO3

InChI

InChI=1S/C23H29NO5S/c1-2-3-4-5-6-7-8-9-11-18-17-24(23(25)22-12-10-15-29-22)21-14-13-19(16-20(18)21)30(26,27)28/h10,12-17H,2-9,11H2,1H3,(H,26,27,28)