methyl (2S)-2-[[(Z)-4-oxidanylidene-4-phenyl-but-2-en-2-yl]amino]-3-(4-phenylmethoxyphenyl)propanoate

Systemtic Name: methyl (2S)-2-[[(Z)-4-oxidanylidene-4-phenyl-but-2-en-2-yl]amino]-3-(4-phenylmethoxyphenyl)propanoate Openeye Name: methyl (2S)-3-(4-benzyloxyphenyl)-2-[[(Z)-1-methyl-3-oxo-3-phenyl-prop-1-enyl]amino]propanoate CAS Name: (2S)-2-[[(Z)-4-oxo-4-phenylbut-2-en-2-yl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(Z)-4-oxo-4-phenylbut-2-en-2-yl]amino]-3-(4-phenylmethoxyphenyl)propanoate Traditional Name: (2S)-3-(4-benzoxyphenyl)-2-[[(Z)-3-keto-1-methyl-3-phenyl-prop-1-enyl]amino]propionic acid methyl ester Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=CC=CC=C1)NC(CC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

C/C(=C/C(=O)C1=CC=CC=C1)/N[C@@H](CC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C27H27NO4/c1-20(17-26(29)23-11-7-4-8-12-23)28-25(27(30)31-2)18-21-13-15-24(16-14-21)32-19-22-9-5-3-6-10-22/h3-17,25,28H,18-19H2,1-2H3/b20-17-/t25-/m0/s1