[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] (E)-3-(3-bromophenyl)prop-2-enoate

Systemtic Name: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] (E)-3-(3-bromophenyl)prop-2-enoate Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] (E)-3-(3-bromophenyl)prop-2-enoate CAS Name: (E)-3-(3-bromophenyl)-2-propenoic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] (E)-3-(3-bromophenyl)prop-2-enoate Traditional Name: (E)-3-(3-bromophenyl)acrylic acid [2-(tert-amylamino)-2-keto-ethyl] ester Formula: C16H20BrNO3 MolecularWeight: 354.2389

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)COC(=O)C=CC1=CC(=CC=C1)Br

Isomeric SMILES

CCC(C)(C)NC(=O)COC(=O)/C=C/C1=CC(=CC=C1)Br

InChI

InChI=1S/C16H20BrNO3/c1-4-16(2,3)18-14(19)11-21-15(20)9-8-12-6-5-7-13(17)10-12/h5-10H,4,11H2,1-3H3,(H,18,19)/b9-8+