[2-(tert-butylamino)-2-oxidanylidene-ethyl] (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-methoxyphenyl)-2-propenoic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-methoxyphenyl)acrylic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)NC(=O)COC(=O)/C(=C/C1=CC=C(C=C1)OC)/C#N

InChI

InChI=1S/C17H20N2O4/c1-17(2,3)19-15(20)11-23-16(21)13(10-18)9-12-5-7-14(22-4)8-6-12/h5-9H,11H2,1-4H3,(H,19,20)/b13-9+