[(2S)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: [(1S)-2-(4-benzyloxyanilino)-1-methyl-2-oxo-ethyl] (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid [(2S)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid [(1S)-2-(4-benzoxyanilino)-2-keto-1-methyl-ethyl] ester Formula: C28H24N2O4 MolecularWeight: 452.50116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)C=CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)/C=C/C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C28H24N2O4/c1-20(34-26(31)17-12-23-10-5-9-22-11-6-18-29-27(22)23)28(32)30-24-13-15-25(16-14-24)33-19-21-7-3-2-4-8-21/h2-18,20H,19H2,1H3,(H,30,32)/b17-12+/t20-/m0/s1