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

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 2-naphthalen-1-yl-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 2-(1-naphthyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(1-naphthalenyl)-1,3-dioxo-5-isoindolecarboxylic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 2-naphthalen-1-yl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(1-naphthyl)isoindoline-5-carboxylic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C29H29NO4 MolecularWeight: 455.54486

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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=CC5=CC=CC=C54)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC5=CC=CC=C54)C(C)C

InChI

InChI=1S/C29H29NO4/c1-17(2)21-13-11-18(3)15-26(21)34-29(33)20-12-14-23-24(16-20)28(32)30(27(23)31)25-10-6-8-19-7-4-5-9-22(19)25/h4-10,12,14,16-18,21,26H,11,13,15H2,1-3H3