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

Systemtic Name: (2-azanylquinolin-8-yl) 2,4,6-tri(propan-2-yl)benzenesulfonate Openeye Name: (2-amino-8-quinolyl) 2,4,6-triisopropylbenzenesulfonate CAS Name: 2,4,6-tri(propan-2-yl)benzenesulfonic acid (2-amino-8-quinolinyl) ester IUPAC Name: (2-aminoquinolin-8-yl) 2,4,6-tri(propan-2-yl)benzenesulfonate Traditional Name: 2,4,6-triisopropylbenzenesulfonic acid (2-amino-8-quinolyl) ester Formula: C24H30N2O3S MolecularWeight: 426.5716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OC2=CC=CC3=C2N=C(C=C3)N)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OC2=CC=CC3=C2N=C(C=C3)N)C(C)C

InChI

InChI=1S/C24H30N2O3S/c1-14(2)18-12-19(15(3)4)24(20(13-18)16(5)6)30(27,28)29-21-9-7-8-17-10-11-22(25)26-23(17)21/h7-16H,1-6H3,(H2,25,26)