[3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoate

Systemtic Name: [3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoate Openeye Name: [3-(isobutylcarbamoyl)-2-oxo-chromen-7-yl] (E)-3-(3-bromo-4-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-bromo-4-methoxyphenyl)-2-propenoic acid [3-[(2-methylpropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methylpropylcarbamoyl)-2-oxochromen-7-yl] (E)-3-(3-bromo-4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-bromo-4-methoxy-phenyl)acrylic acid [3-(isobutylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C24H22BrNO6 MolecularWeight: 500.33858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C=CC3=CC(=C(C=C3)OC)Br)OC1=O

Isomeric SMILES

CC(C)CNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)/C=C/C3=CC(=C(C=C3)OC)Br)OC1=O

InChI

InChI=1S/C24H22BrNO6/c1-14(2)13-26-23(28)18-11-16-6-7-17(12-21(16)32-24(18)29)31-22(27)9-5-15-4-8-20(30-3)19(25)10-15/h4-12,14H,13H2,1-3H3,(H,26,28)/b9-5+