[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl] 4-(3-methyl-4-propan-2-yl-phenoxy)butanoate

Systemtic Name: [4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl] 4-(3-methyl-4-propan-2-yl-phenoxy)butanoate Openeye Name: [4-(1,3-dioxoisoindolin-2-yl)phenyl] 4-(4-isopropyl-3-methyl-phenoxy)butanoate CAS Name: 4-(3-methyl-4-propan-2-ylphenoxy)butanoic acid [4-(1,3-dioxo-2-isoindolyl)phenyl] ester IUPAC Name: [4-(1,3-dioxoisoindol-2-yl)phenyl] 4-(3-methyl-4-propan-2-ylphenoxy)butanoate Traditional Name: 4-(4-isopropyl-3-methyl-phenoxy)butyric acid (4-phthalimidophenyl) ester Formula: C28H27NO5 MolecularWeight: 457.51768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)OC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)OC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)C(C)C

InChI

InChI=1S/C28H27NO5/c1-18(2)23-15-14-22(17-19(23)3)33-16-6-9-26(30)34-21-12-10-20(11-13-21)29-27(31)24-7-4-5-8-25(24)28(29)32/h4-5,7-8,10-15,17-18H,6,9,16H2,1-3H3