1,4-dimethyl-7-propan-2-yl-2H-azulene-1-sulfonic acid

Systemtic Name: 1,4-dimethyl-7-propan-2-yl-2H-azulene-1-sulfonic acid Openeye Name: 7-isopropyl-1,4-dimethyl-2H-azulene-1-sulfonic acid CAS Name: 1,4-dimethyl-7-propan-2-yl-2H-azulene-1-sulfonic acid IUPAC Name: 1,4-dimethyl-7-propan-2-yl-2H-azulene-1-sulfonic acid Traditional Name: 7-isopropyl-1,4-dimethyl-2H-azulene-1-sulfonic acid Formula: C15H20O3S MolecularWeight: 280.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C2C1=CCC2(C)S(=O)(=O)O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C2C1=CCC2(C)S(=O)(=O)O)C(C)C

InChI

InChI=1S/C15H20O3S/c1-10(2)12-6-5-11(3)13-7-8-15(4,14(13)9-12)19(16,17)18/h5-7,9-10H,8H2,1-4H3,(H,16,17,18)