2-[2,2,4-trimethyl-1-[(1R)-1-oxidanylbut-3-enyl]quinolin-6-yl]benzene-1,3-diol

Systemtic Name: 2-[2,2,4-trimethyl-1-[(1R)-1-oxidanylbut-3-enyl]quinolin-6-yl]benzene-1,3-diol Openeye Name: 2-[1-[(1R)-1-hydroxybut-3-enyl]-2,2,4-trimethyl-6-quinolyl]benzene-1,3-diol CAS Name: 2-[1-[(1R)-1-hydroxybut-3-enyl]-2,2,4-trimethyl-6-quinolinyl]benzene-1,3-diol IUPAC Name: 2-[1-[(1R)-1-hydroxybut-3-enyl]-2,2,4-trimethylquinolin-6-yl]benzene-1,3-diol Traditional Name: 2-[1-[(1R)-1-hydroxybut-3-enyl]-2,2,4-trimethyl-6-quinolyl]resorcinol Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=C(C=C2)C3=C(C=CC=C3O)O)C(CC=C)O)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=C(C=C2)C3=C(C=CC=C3O)O)[C@@H](CC=C)O)(C)C

InChI

InChI=1S/C22H25NO3/c1-5-7-20(26)23-17-11-10-15(21-18(24)8-6-9-19(21)25)12-16(17)14(2)13-22(23,3)4/h5-6,8-13,20,24-26H,1,7H2,2-4H3/t20-/m1/s1