(5-methyl-2-propan-2-yl-cyclohexyl) 1,3-bis(oxidanylidene)-2-phenyl-isoindole-5-carboxylate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 1,3-bis(oxidanylidene)-2-phenyl-isoindole-5-carboxylate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 1,3-dioxo-2-phenyl-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-phenyl-5-isoindolecarboxylic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 1,3-dioxo-2-phenylisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-phenyl-isoindoline-5-carboxylic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C25H27NO4/c1-15(2)19-11-9-16(3)13-22(19)30-25(29)17-10-12-20-21(14-17)24(28)26(23(20)27)18-7-5-4-6-8-18/h4-8,10,12,14-16,19,22H,9,11,13H2,1-3H3