(2-methylquinolin-8-yl) 2,4,6-tri(propan-2-yl)benzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) 2,4,6-tri(propan-2-yl)benzenesulfonate Openeye Name: (2-methyl-8-quinolyl) 2,4,6-triisopropylbenzenesulfonate CAS Name: 2,4,6-tri(propan-2-yl)benzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 2,4,6-tri(propan-2-yl)benzenesulfonate Traditional Name: 2,4,6-triisopropylbenzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C25H31NO3S MolecularWeight: 425.58354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=C(C=C(C=C3C(C)C)C(C)C)C(C)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=C(C=C(C=C3C(C)C)C(C)C)C(C)C)C=C1

InChI

InChI=1S/C25H31NO3S/c1-15(2)20-13-21(16(3)4)25(22(14-20)17(5)6)30(27,28)29-23-10-8-9-19-12-11-18(7)26-24(19)23/h8-17H,1-7H3