3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)propyl (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-methoxy-4-propoxyphenyl)-2-propenoic acid 3-(5-bromo-1,3-dioxo-2-isoindolyl)propyl ester IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)propyl (E)-3-(3-methoxy-4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-methoxy-4-propoxy-phenyl)acrylic acid 3-(5-bromo-1,3-diketo-isoindolin-2-yl)propyl ester Formula: C24H24BrNO6 MolecularWeight: 502.35446

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)OC

InChI

InChI=1S/C24H24BrNO6/c1-3-12-31-20-9-5-16(14-21(20)30-2)6-10-22(27)32-13-4-11-26-23(28)18-8-7-17(25)15-19(18)24(26)29/h5-10,14-15H,3-4,11-13H2,1-2H3/b10-6+