3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl 4-(4-propan-2-ylphenoxy)butanoate

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl 4-(4-propan-2-ylphenoxy)butanoate Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)propyl 4-(4-isopropylphenoxy)butanoate CAS Name: 4-(4-propan-2-ylphenoxy)butanoic acid 3-(5-bromo-1,3-dioxo-2-isoindolyl)propyl ester IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)propyl 4-(4-propan-2-ylphenoxy)butanoate Traditional Name: 4-(4-isopropylphenoxy)butyric acid 3-(5-bromo-1,3-diketo-isoindolin-2-yl)propyl ester Formula: C24H26BrNO5 MolecularWeight: 488.37094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCCCC(=O)OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCCCC(=O)OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C24H26BrNO5/c1-16(2)17-6-9-19(10-7-17)30-13-3-5-22(27)31-14-4-12-26-23(28)20-11-8-18(25)15-21(20)24(26)29/h6-11,15-16H,3-5,12-14H2,1-2H3