(3aS,9bR)-1,3,3a-tributyl-9b-oxidanyl-5H-imidazo[4,5-c]quinoline-2,4-dione

Systemtic Name: (3aS,9bR)-1,3,3a-tributyl-9b-oxidanyl-5H-imidazo[4,5-c]quinoline-2,4-dione Openeye Name: (3aS,9bR)-1,3,3a-tributyl-9b-hydroxy-5H-imidazo[4,5-c]quinoline-2,4-dione CAS Name: (3aS,9bR)-1,3,3a-tributyl-9b-hydroxy-5H-imidazo[4,5-c]quinoline-2,4-dione IUPAC Name: (3aS,9bR)-1,3,3a-tributyl-9b-hydroxy-5H-imidazo[4,5-c]quinoline-2,4-dione Traditional Name: (3aS,9bR)-1,3,3a-tributyl-9b-hydroxy-5H-imidazo[4,5-c]quinoline-2,4-quinone Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC12C(=O)NC3=CC=CC=C3C1(N(C(=O)N2CCCC)CCCC)O

Isomeric SMILES

CCCC[C@@]12C(=O)NC3=CC=CC=C3[C@@]1(N(C(=O)N2CCCC)CCCC)O

InChI

InChI=1S/C22H33N3O3/c1-4-7-14-21-19(26)23-18-13-11-10-12-17(18)22(21,28)25(16-9-6-3)20(27)24(21)15-8-5-2/h10-13,28H,4-9,14-16H2,1-3H3,(H,23,26)/t21-,22-/m1/s1