(3,3-dimethyl-2-oxidanylidene-butyl) 3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: 3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-propenoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: 3-[4-(cyanomethoxy)-3-methoxy-phenyl]acrylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C=CC1=CC(=C(C=C1)OCC#N)OC

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C=CC1=CC(=C(C=C1)OCC#N)OC

InChI

InChI=1S/C18H21NO5/c1-18(2,3)16(20)12-24-17(21)8-6-13-5-7-14(23-10-9-19)15(11-13)22-4/h5-8,11H,10,12H2,1-4H3