2-phenylmethoxy-5-[3,3,6,6-tetramethyl-1,8-bis(oxidanylidene)-2,4,5,7,9,10-hexahydroacridin-9-yl]benzoic acid

Systemtic Name: 2-phenylmethoxy-5-[3,3,6,6-tetramethyl-1,8-bis(oxidanylidene)-2,4,5,7,9,10-hexahydroacridin-9-yl]benzoic acid Openeye Name: 2-benzyloxy-5-(3,3,6,6-tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzoic acid CAS Name: 2-phenylmethoxy-5-(3,3,6,6-tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzoic acid IUPAC Name: 2-phenylmethoxy-5-(3,3,6,6-tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzoic acid Traditional Name: 2-benzoxy-5-(1,8-diketo-3,3,6,6-tetramethyl-2,4,5,7,9,10-hexahydroacridin-9-yl)benzoic acid Formula: C31H33NO5 MolecularWeight: 499.59742

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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=C4)OCC5=CC=CC=C5)C(=O)O)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC(=C(C=C4)OCC5=CC=CC=C5)C(=O)O)C(=O)C1)C

InChI

InChI=1S/C31H33NO5/c1-30(2)13-21-27(23(33)15-30)26(28-22(32-21)14-31(3,4)16-24(28)34)19-10-11-25(20(12-19)29(35)36)37-17-18-8-6-5-7-9-18/h5-12,26,32H,13-17H2,1-4H3,(H,35,36)