4-(2,3,3-trimethylinden-1-yl)butane-1-sulfonic acid

Systemtic Name: 4-(2,3,3-trimethylinden-1-yl)butane-1-sulfonic acid Openeye Name: 4-(2,3,3-trimethylinden-1-yl)butane-1-sulfonic acid CAS Name: 4-(2,3,3-trimethyl-1-indenyl)-1-butanesulfonic acid IUPAC Name: 4-(2,3,3-trimethylinden-1-yl)butane-1-sulfonic acid Traditional Name: 4-(2,3,3-trimethylinden-1-yl)butane-1-sulfonic acid Formula: C16H22O3S MolecularWeight: 294.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C1(C)C)CCCCS(=O)(=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2C1(C)C)CCCCS(=O)(=O)O

InChI

InChI=1S/C16H22O3S/c1-12-13(8-6-7-11-20(17,18)19)14-9-4-5-10-15(14)16(12,2)3/h4-5,9-10H,6-8,11H2,1-3H3,(H,17,18,19)