4'-tert-butyl-9-methoxy-spiro[3H-benzo[h][1,3]benzoxazine-2,1'-cyclohexane]-4-one

Systemtic Name: 4'-tert-butyl-9-methoxy-spiro[3H-benzo[h][1,3]benzoxazine-2,1'-cyclohexane]-4-one Openeye Name: 4'-tert-butyl-9-methoxy-spiro[3H-benzo[h][1,3]benzoxazine-2,1'-cyclohexane]-4-one CAS Name: 4'-tert-butyl-9-methoxy-4-spiro[3H-benzo[h][1,3]benzoxazine-2,1'-cyclohexane]one IUPAC Name: 4'-tert-butyl-9-methoxyspiro[3H-benzo[h][1,3]benzoxazine-2,1'-cyclohexane]-4-one Traditional Name: 4'-tert-butyl-9-methoxy-spiro[3H-benzo[h][1,3]benzoxazine-2,1'-cyclohexane]-4-one Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2(CC1)NC(=O)C3=C(O2)C4=C(C=CC(=C4)OC)C=C3

Isomeric SMILES

CC(C)(C)C1CCC2(CC1)NC(=O)C3=C(O2)C4=C(C=CC(=C4)OC)C=C3

InChI

InChI=1S/C22H27NO3/c1-21(2,3)15-9-11-22(12-10-15)23-20(24)17-8-6-14-5-7-16(25-4)13-18(14)19(17)26-22/h5-8,13,15H,9-12H2,1-4H3,(H,23,24)