(5-methyl-2-propan-2-yl-cyclohexyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 2-(1,3-dioxoisoindolin-2-yl)-3-methyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-3-methylbutanoic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 2-(1,3-dioxoisoindol-2-yl)-3-methylbutanoate Traditional Name: 3-methyl-2-phthalimido-butyric acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C23H31NO4 MolecularWeight: 385.49654

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(C(C)C)N2C(=O)C3=CC=CC=C3C2=O)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)C(C(C)C)N2C(=O)C3=CC=CC=C3C2=O)C(C)C

InChI

InChI=1S/C23H31NO4/c1-13(2)16-11-10-15(5)12-19(16)28-23(27)20(14(3)4)24-21(25)17-8-6-7-9-18(17)22(24)26/h6-9,13-16,19-20H,10-12H2,1-5H3