2-[5-bromanyl-2-methoxy-4-[3,3,6,6-tetramethyl-1,8-bis(oxidanylidene)-2,4,5,7,9,10-hexahydroacridin-9-yl]phenoxy]ethanoate

Systemtic Name: 2-[5-bromanyl-2-methoxy-4-[3,3,6,6-tetramethyl-1,8-bis(oxidanylidene)-2,4,5,7,9,10-hexahydroacridin-9-yl]phenoxy]ethanoate Openeye Name: 2-[5-bromo-2-methoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)phenoxy]acetate CAS Name: 2-[5-bromo-2-methoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)phenoxy]acetate IUPAC Name: 2-[5-bromo-2-methoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)phenoxy]acetate Traditional Name: 2-[5-bromo-4-(1,8-diketo-3,3,6,6-tetramethyl-2,4,5,7,9,10-hexahydroacridin-9-yl)-2-methoxy-phenoxy]acetate Formula: C26H29BrNO6- MolecularWeight: 531.41556

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC(=C(C=C4Br)OCC(=O)[O-])OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC(=C(C=C4Br)OCC(=O)[O-])OC)C(=O)C1)C

InChI

InChI=1S/C26H30BrNO6/c1-25(2)8-15-23(17(29)10-25)22(24-16(28-15)9-26(3,4)11-18(24)30)13-6-19(33-5)20(7-14(13)27)34-12-21(31)32/h6-7,22,28H,8-12H2,1-5H3,(H,31,32)/p-1