(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate CAS Name: 2-cyano-3-(4-dimethylaminophenyl)-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 2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate Traditional Name: 2-cyano-3-(4-dimethylaminophenyl)acrylic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C26H26N2O4 MolecularWeight: 430.49564

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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)N(C)C)C#N)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C26H26N2O4/c1-16(2)22-13-23-20(12-25(29)32-24(23)10-17(22)3)15-31-26(30)19(14-27)11-18-6-8-21(9-7-18)28(4)5/h6-13,16H,15H2,1-5H3