2'-methylspiro[cyclohexane-1,3'-indole]-5'-sulfonic acid; triethylazanium

Systemtic Name: 2'-methylspiro[cyclohexane-1,3'-indole]-5'-sulfonic acid; triethylazanium Openeye Name: 2'-methylspiro[cyclohexane-1,3'-indole]-5'-sulfonic acid; triethylammonium CAS Name: 2'-methyl-5'-spiro[cyclohexane-1,3'-indole]sulfonic acid; triethylammonium IUPAC Name: 2'-methylspiro[cyclohexane-1,3'-indole]-5'-sulfonic acid; triethylazanium Traditional Name: 2'-methylspiro[cyclohexane-1,3'-indole]-5'-sulfonic acid; triethylammonium Formula: C20H33N2O3S+ MolecularWeight: 381.55262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC.CC1=NC2=C(C13CCCCC3)C=C(C=C2)S(=O)(=O)O

Isomeric SMILES

CC[NH+](CC)CC.CC1=NC2=C(C13CCCCC3)C=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C14H17NO3S.C6H15N/c1-10-14(7-3-2-4-8-14)12-9-11(19(16,17)18)5-6-13(12)15-10;1-4-7(5-2)6-3/h5-6,9H,2-4,7-8H2,1H3,(H,16,17,18);4-6H2,1-3H3/p+1