2-[4-chloranyl-2-[3,3,6,6-tetramethyl-1,8-bis(oxidanylidene)-10-(phenylmethyl)-4,5,7,9-tetrahydro-2H-acridin-9-yl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-chloranyl-2-[3,3,6,6-tetramethyl-1,8-bis(oxidanylidene)-10-(phenylmethyl)-4,5,7,9-tetrahydro-2H-acridin-9-yl]phenoxy]ethanoic acid Openeye Name: 2-[2-(10-benzyl-3,3,6,6-tetramethyl-1,8-dioxo-4,5,7,9-tetrahydro-2H-acridin-9-yl)-4-chloro-phenoxy]acetic acid CAS Name: 2-[4-chloro-2-[3,3,6,6-tetramethyl-1,8-dioxo-10-(phenylmethyl)-4,5,7,9-tetrahydro-2H-acridin-9-yl]phenoxy]acetic acid IUPAC Name: 2-[2-(10-benzyl-3,3,6,6-tetramethyl-1,8-dioxo-4,5,7,9-tetrahydro-2H-acridin-9-yl)-4-chlorophenoxy]acetic acid Traditional Name: 2-[2-(10-benzyl-1,8-diketo-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-acridin-9-yl)-4-chloro-phenoxy]acetic acid Formula: C32H34ClNO5 MolecularWeight: 548.06906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(N2CC4=CC=CC=C4)CC(CC3=O)(C)C)C5=C(C=CC(=C5)Cl)OCC(=O)O)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(N2CC4=CC=CC=C4)CC(CC3=O)(C)C)C5=C(C=CC(=C5)Cl)OCC(=O)O)C(=O)C1)C

InChI

InChI=1S/C32H34ClNO5/c1-31(2)13-22-29(24(35)15-31)28(21-12-20(33)10-11-26(21)39-18-27(37)38)30-23(14-32(3,4)16-25(30)36)34(22)17-19-8-6-5-7-9-19/h5-12,28H,13-18H2,1-4H3,(H,37,38)