[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: [(1S)-2-(tert-butylamino)-1-methyl-2-oxo-ethyl] (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl] (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid [(1S)-2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)C=CC1=CC=CC2=C1N=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NC(C)(C)C)OC(=O)/C=C/C1=CC=CC2=C1N=CC=C2

InChI

InChI=1S/C19H22N2O3/c1-13(18(23)21-19(2,3)4)24-16(22)11-10-15-8-5-7-14-9-6-12-20-17(14)15/h5-13H,1-4H3,(H,21,23)/b11-10+/t13-/m0/s1