4-[(1,1,2,3,3,6-hexamethyl-2H-inden-5-yl)methylideneamino]benzenesulfonic acid

Systemtic Name: 4-[(1,1,2,3,3,6-hexamethyl-2H-inden-5-yl)methylideneamino]benzenesulfonic acid Openeye Name: 4-[(1,1,2,3,3,6-hexamethylindan-5-yl)methyleneamino]benzenesulfonic acid CAS Name: 4-[(1,1,2,3,3,6-hexamethyl-2H-inden-5-yl)methylideneamino]benzenesulfonic acid IUPAC Name: 4-[(1,1,2,3,3,6-hexamethyl-2H-inden-5-yl)methylideneamino]benzenesulfonic acid Traditional Name: 4-[(1,1,2,3,3,6-hexamethylindan-5-yl)methyleneamino]besylic acid Formula: C22H27NO3S MolecularWeight: 385.51968

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C(C1(C)C)C=C(C(=C2)C)C=NC3=CC=C(C=C3)S(=O)(=O)O)(C)C

Isomeric SMILES

CC1C(C2=C(C1(C)C)C=C(C(=C2)C)C=NC3=CC=C(C=C3)S(=O)(=O)O)(C)C

InChI

InChI=1S/C22H27NO3S/c1-14-11-19-20(22(5,6)15(2)21(19,3)4)12-16(14)13-23-17-7-9-18(10-8-17)27(24,25)26/h7-13,15H,1-6H3,(H,24,25,26)