(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(cyanomethoxy)phenyl]-2-propenoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(cyanomethoxy)phenyl]acrylic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C25H23NO5 MolecularWeight: 417.45382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C=CC3=CC=C(C=C3)OCC#N)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)/C=C/C3=CC=C(C=C3)OCC#N)C(C)C

InChI

InChI=1S/C25H23NO5/c1-16(2)21-14-22-19(13-25(28)31-23(22)12-17(21)3)15-30-24(27)9-6-18-4-7-20(8-5-18)29-11-10-26/h4-9,12-14,16H,11,15H2,1-3H3/b9-6+