(4aS,5R,10bR)-9-tert-butyl-5-phenyl-2,3,4a,5,6,10b-hexahydro-[1,4]dioxino[2,3-c]quinoline

Systemtic Name: (4aS,5R,10bR)-9-tert-butyl-5-phenyl-2,3,4a,5,6,10b-hexahydro-[1,4]dioxino[2,3-c]quinoline Openeye Name: (4aS,5R,10bR)-9-tert-butyl-5-phenyl-2,3,4a,5,6,10b-hexahydro-[1,4]dioxino[2,3-c]quinoline CAS Name: (4aS,5R,10bR)-9-tert-butyl-5-phenyl-2,3,4a,5,6,10b-hexahydro-[1,4]dioxino[2,3-c]quinoline IUPAC Name: (4aS,5R,10bR)-9-tert-butyl-5-phenyl-2,3,4a,5,6,10b-hexahydro-[1,4]dioxino[2,3-c]quinoline Traditional Name: (4aS,5R,10bR)-9-tert-butyl-5-phenyl-2,3,4a,5,6,10b-hexahydro-[1,4]dioxino[2,3-c]quinoline Formula: C21H25NO2 MolecularWeight: 323.4287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)NC(C3C2OCCO3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)N[C@@H]([C@H]3[C@@H]2OCCO3)C4=CC=CC=C4

InChI

InChI=1S/C21H25NO2/c1-21(2,3)15-9-10-17-16(13-15)19-20(24-12-11-23-19)18(22-17)14-7-5-4-6-8-14/h4-10,13,18-20,22H,11-12H2,1-3H3/t18-,19-,20+/m1/s1